Mocetinostat (MGCD0103) - Moligand™, ≥98% , Inhibitor of histone deacetylase 1;Inhibitor of histone deacetylase 2;Inhibitor of histone deacetylase 3, CAS No.726169-73-9, Inhibitor of histone deacetylase 1;Inhibitor of histone deacetylase 2;Inhibitor of histone deacetylase 3

CAS: 726169-73-9 Cat. No.: M126151 Molecular Weight: 396.44
AVAILABLE TO ORDER
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
MFCD10565970 | MGCD0103 - Mocetinostat | NCGC00263182-11 | UNII-A6GWB8T96J | DTXSID80222945 | HMS3426I07 | STK387500 | SCHEMBL157027 | AKOS015916602 | MG 0103 | BRD-K16485616-001-04-8 | FT-0627651 | HRNLUBSXIHFDHP-UHFFFAOYSA-N | MOCETINOSTAT [INN] | N-(2-
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5mg
M126151-5mg
6
$97.90
25mg
M126151-25mg
3
$198.90
50mg
M126151-50mg
3
$377.90
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 21 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Mocetinostat (MGCD0103) is a potent HDAC inhibitor with most potency for HDAC1 with IC50 of 0.15 μM, 2- to 10- fold selectivity against HDAC2, 3, and 11, and no activity to HDAC4, 5, 6, 7, and 8. Phase 2.
A potent inhibitor of HDAC1, HDAC2, HDAC3, and HDAC11.

Specifications

Synonyms
MFCD10565970 | MGCD0103 - Mocetinostat | NCGC00263182-11 | UNII-A6GWB8T96J | DTXSID80222945 | HMS3426I07 | STK387500 | SCHEMBL157027 | AKOS015916602 | MG 0103 | BRD-K16485616-001-04-8 | FT-0627651 | HRNLUBSXIHFDHP-UHFFFAOYSA-N | MOCETINOSTAT [INN] | N-(2-
Specifications & Purity
Moligand™, ≥98%
Biochemical and Physiological Mechanisms
MGCD0103 potently inhibits a subset of the nine human recombinant HDACs, including HDAC1, HDAC2, HDAC3, and HDAC11. MGCD0103 reveals most potent inhibitory activity against human HDAC1 and HDAC2 enzymes in vitro, and it does not inhibit class II HDACs. T
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Moligand™
Action Type
INHIBITOR
Mechanism of action
Inhibitor of histone deacetylase 1;Inhibitor of histone deacetylase 2;Inhibitor of histone deacetylase 3
Purity
≥98%
Product Properties
ALogP2.8
Names and Identifiers
Pubchem Sid504765009
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504765009
Canonical SmilesC1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC3=NC=CC(=N3)C4=CN=CC=C4
IUPAC NameN-(2-aminophenyl)-4-[[(4-pyridin-3-ylpyrimidin-2-yl)amino]methyl]benzamide
InChIKeyHRNLUBSXIHFDHP-UHFFFAOYSA-N
INCHI1S/C23H20N6O/c24-19-5-1-2-6-21(19)28-22(30)17-9-7-16(8-10-17)14-27-23-26-13-11-20(29-23)18-4-3-12-25-15-18/h1-13,15H,14,24H2,(H,28,30)(H,26,27,29)
Isomeric SMILES C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC3=NC=CC(=N3)C4=CN=CC=C4
Molecular Weight 396.44
Reaxy-Rn 14262919
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14262919&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassAnilides
Intermediate Tree Nodes Aromatic anilides
Direct ParentBenzanilides
Alternative Parents Pyridinylpyrimidines  Benzamides  Aniline and substituted anilines  Benzylamines  Benzoyl derivatives  Secondary alkylarylamines  Aminopyrimidines and derivatives  Pyridines and derivatives  Heteroaromatic compounds  Secondary carboxylic acid amides  Amino acids and derivatives  Azacyclic compounds  Hydrocarbon derivatives  Organic oxides  Organooxygen compounds  Organopnictogen compounds  Primary amines  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Benzanilide - Pyridinylpyrimidine - Benzamide - Benzoic acid or derivatives - Benzoyl - Benzylamine - Aniline or substituted anilines - Aminopyrimidine - Secondary aliphatic/aromatic amine - Pyridine - Pyrimidine - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Secondary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
CYP3A4 Tclin Cytochrome P450 3A4 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HDAC1 Tclin Histone deacetylase 1 (17 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HDAC11 Tclin Histone deacetylase 11 (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HDAC2 Tclin Histone deacetylase 2 (11 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HDAC3 Tclin Histone deacetylase 3 (5 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
TOP2A Tclin DNA topoisomerase II alpha (6317 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNH2 Tclin HERG (29587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
LTA4H Tchem Leukotriene A4 hydrolase (1442 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ADORA2A Tclin Adenosine A2a receptor (16305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALB Tchem Serum albumin (2651 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC8 Tclin Histone deacetylase 8 (4516 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC2 Tclin Histone deacetylase 2 (3971 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC3 Tclin Histone deacetylase 3 (3654 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC4 Tclin Histone deacetylase 4 (2328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC9 Tclin Histone deacetylase 9 (708 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC11 Tclin Histone deacetylase 11 (967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC7 Tclin Histone deacetylase 7 (1047 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Homo sapiens (32628 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
DU-145 (51482 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PC-3 (62116 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
T-24 (2342 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U-937 (7138 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
A549 (127892 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
A-431 (6446 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCT-116 (91556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HMEC (560 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Jurkat (10389 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HeLa (62764 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SW-620 (52400 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Liver microsomes (16955 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC3 Tclin Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) (735 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SJSA-1 (970 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC3 Tclin Histone deacetylase 3/NCoR1 (102 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Hdac1 Histone deacetylase 1 (93 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hdac5 Histone deacetylase 5 (5 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HD1 Histone deacetylase (38 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Canis familiaris (36305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MC-38 (857 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CT26 (928 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Plasma (328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeDateItem
H1505067Certificate of AnalysisMar 16, 2023 M126151
Chemical and Physical Properties
SolubilityDMSO 13 mg/mL (32.79 mM); Water <1 mg/mL (<1 mM); Ethanol <1 mg/mL (<1 mM)
Molecular Weight396.400 g/mol
XLogP32.800
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass396.17 Da
Monoisotopic Mass396.17 Da
Topological Polar Surface Area106.000 Ų
Heavy Atom Count30
Formal Charge0
Complexity538.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Documents & Articles
Citations of This Product
References
1. Si-Ke Chen, Da-Wei Pan, Zhuang Liu, Wei Wang, Rui Xie, Xiao-Ting Mu, Xiao-Jie Ju, Liang-Yin Chu.  (2023)  Microfluidic Fabrication of Calcium Alginate/Chitosan Composite Microcapsules with Ultrathin Shells for Peroxidase Immobilization.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.3c01062]
2. Wenfang Song, Hong Lu, Qiansheng Li, Xiaolei Wang, Ze Fu, Jiti Zhou.  (2023)  Aerobic degradation of ketoprofen by marine consortia: Fenton-like reaction and degradation pathway.  SCIENCE OF THE TOTAL ENVIRONMENT,      [PMID:37263434] [10.1016/j.scitotenv.2023.164520]
3. Cong Pan, Wenyu Wang, Chenchong Fu, Jong Chol Nam, Feng Wu, Zhixiong You, Jing Xu, Jinjun Li.  (2023)  Promoted wet peroxide oxidation of chlorinated volatile organic compounds catalyzed by FeOCl supported on macro-microporous biomass-derived activated carbon.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:37201460] [10.1016/j.jcis.2023.05.004]
4. Junpeng Yue, Hanpei Yang, Chen Liu, Qiang Zhang, Yanhui Ao.  (2023)  Constructing photocatalysis-self-Fenton system over a defective twin C3N4: In-situ producing H2O2 and mineralizing organic pollutants.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2023.122716]
5. Jianwen Zhou, Tianshang Shan, Hao Luo, Bruno Boury, Xia Xu, Hui Wu, Fengshan Zhang, He Xiao.  (2023)  Enhanced single-electron transfer for efficiently photocatalytic H2O2 production over g-C3N4 decorated with TEMPO-oxidized cellulosic carbon.  Journal of Environmental Chemical Engineering,      [PMID:] [10.1016/j.jece.2023.109512]
6. Xin Zhang, Qingling Fu, Hongqing Hu, Jun Zhu, Yonghong Liu.  (2023)  Effects of Fe(II) on As(III) oxidation in Fe(II)-As(III) co-oxidation: Limiting and driving roles.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:36669406] [10.1016/j.jhazmat.2023.130790]
7. Qingli Qu, Weixia Cheng, Xiaoli Zhang, Hossein Ravanbakhsh, Guosheng Tang, Aying Zhou, Dong Pei, Ranhua Xiong, Chaobo Huang.  (2022)  Glucose-Responsive Enzymatic Cascade Microreactors in Gas-Shearing Microfluidics Microcapsules.  Advanced Materials Technologies,  (5): (2201559).  [PMID:] [10.1002/admt.202201559]
8. Chenchong Fu, Cong Pan, Tao Chen, Deqin Peng, Yaqian Liu, Feng Wu, Jing Xu, Zhixiong You, Jinjun Li, Liting Luo.  (2022)  Adsorption-enforced Fenton-like process using activated carbon-supported iron oxychloride catalyst for wet scrubbing of airborne dichloroethane.  CHEMOSPHERE,      [PMID:36037963] [10.1016/j.chemosphere.2022.136193]
9. Qingli Qu, Weixia Cheng, Xiaoli Zhang, Aying Zhou, Yankang Deng, Miaomiao Zhu, Tianjiao Chu, Bella B. Manshian, Ranhua Xiong, Stefaan J. Soenen, Kevin Braeckmans, Stefaan C. De Smedt, Chaobo Huang.  (2022)  Multicompartmental Microcapsules for Enzymatic Cascade Reactions Prepared through Gas Shearing and Surface Gelation.  BIOMACROMOLECULES,      [PMID:35931466] [10.1021/acs.biomac.2c00324]
10. Cailiang Yue, Changqing Zhu, Wenting Zheng, Jinli Qiu, Zhiling Du, Chen Ling, Fu-Qiang Liu.  (2021)  Plasmonic Bi NP-accelerated interfacial charge transfer for enhanced solar-driven ciprofloxacin mineralization.  Environmental Science-Nano,  (1): (349-360).  [PMID:] [10.1039/D1EN00896J]
11. Shuangqin Li, Di Liu, Bingyan Wu, Huipeng Sun, Xiaoyan Liu, Haixia Zhang, Nana Ding, Lan Wu.  (2021)  One-pot synthesis of a peroxidase-like nanozyme and its application in visual assay for tyrosinase activity.  TALANTA,      [PMID:34838324] [10.1016/j.talanta.2021.123088]
12. Teng Ge, Xiaoli Jin, Jian Cao, Zhuohua Chen, Yixue Xu, Haiquan Xie, Fengyun Su, Xin Li, Qing Lan, Liqun Ye.  (2021)  Giant enhanced photocatalytic H2O2 production over hollow hexagonal prisms carbon nitride.  Journal of the Taiwan Institute of Chemical Engineers,      [PMID:] [10.1016/j.jtice.2021.09.036]
13. Qingli Qu, Xiaoli Zhang, Hossein Ravanbakhsh, Guosheng Tang, Jian Zhang, Yankang Deng, Kevin Braeckmans, Stefaan C. De Smedt, Ranhua Xiong, Chaobo Huang.  (2021)  Gas-shearing synthesis of core–shell multicompartmental microparticles as cell-like system for enzymatic cascade reaction.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.132607]
14. Yuqing Wu, Lei Cao, Minghui Zan, Zheng Hou, Mingfeng Ge, Wen-Fei Dong, Li Li.  (2021)  Iron and nitrogen-co-doped carbon quantum dots for the sensitive and selective detection of hematin and ferric ions and cell imaging.  ANALYST,  146  (15): (4954-4963).  [PMID:34259240] [10.1039/D1AN00828E]
15. Fangfang Zhou, Jianquan Luo, Siqing Song, Yinhua Wan.  (2020)  Nanostructured Polyphenol-Mediated Coating: a Versatile Platform for Enzyme Immobilization and Micropollutant Removal.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.9b05708]
16. Lili Wang, Wencheng Gong, Fang Wang, Zhenya Yu, Zilin Chen.  (2016)  Efficient bienzyme nanocomposite film for chiral recognition of L-tryptophan, L-phenylalanine and L-tyrosine.  Analytical Methods,  (17): (3481-3487).  [PMID:] [10.1039/C5AY03290C]
17. Wang Fang, Gong Wencheng, Wang Lili, Chen Zilin.  (2015)  Enhanced amperometric response of a glucose oxidase and horseradish peroxidase based bienzyme glucose biosensor modified with a film of polymerized toluidine blue containing reduced graphene oxide.  MICROCHIMICA ACTA,  182  (11): (1949-1956).  [PMID:] [10.1007/s00604-015-1535-3]
18. Qixuan Mu, Xinyue Li, Xiuxiu Li, Ruijun Li, Yibing Ji.  (2025)  Laccase-mimicking active inorganic organic hybrid covalent organic framework filtration membrane for rapid removal of drug pollutants.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.166344]
19. Huan Liu, Yan Wang.  (2025)  Flow-driven piezoelectric membranes for autonomous antifouling and energy-efficient water purification.  DESALINATION,      [PMID:] [10.1016/j.desal.2025.119189]
20. Qiansheng Li, Yi Dai, Hong Lu, Xiaoman Li, Fanghao Cheng, Jiti Zhou.  (2025)  Biological Fenton reaction mediated by N and Fe co-doped carbon dots for ketoprofen degradation.  Journal of Environmental Chemical Engineering,      [PMID:] [10.1016/j.jece.2025.118032]
21. Zhuo Liu, Yue Fan, Wanfeng Mao, Dongxu Wang, Lihong Zhao, Duo Meng, Tengfei Wu, Jiaqi Tang.  (2025)  Self-sustained photo–H2O2 system based on pure g-C3N4: High H2O2 production and rapid pollutant elimination without sacrificial agents.  APPLIED SURFACE SCIENCE,      [PMID:] [10.1016/j.apsusc.2025.164570]
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