≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C,Desiccated Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 14 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Mefuparib hydrochloride is a substrate-competitive and selective PARP1/2 inhibitor with IC50s of 3.2 nM and 1.9 nM, respectively. Mefuparib hydrochloride induces apoptosis and possesses prominent anticancer activity in vitro and in vivo.
| Pubchem Sid | 528773897 |
|---|---|
| Canonical Smiles | CNCC1=CC=C(C=C1)C2=CC3=CC(=CC(=C3O2)C(=O)N)F.Cl |
| IUPAC Name | 5-fluoro-2-[4-(methylaminomethyl)phenyl]-1-benzofuran-7-carboxamide;hydrochloride |
| InChIKey | GPFWTAVHQKERKY-UHFFFAOYSA-N |
| INCHI | 1S/C17H15FN2O2.ClH/c1-20-9-10-2-4-11(5-3-10)15-7-12-6-13(18)8-14(17(19)21)16(12)22-15;/h2-8,20H,9H2,1H3,(H2,19,21);1H |
| Isomeric SMILES | CNCC1=CC=C(C=C1)C2=CC3=CC(=CC(=C3O2)C(=O)N)F.Cl |
| Alternate CAS | 1449746-00-2 |
| PubChem CID | 117734810 |
| MeSH Entry Terms | mefuparib hydrochloride;MPH1 cpd |
| Molecular Weight | 334.77 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Phenylpropanoids and polyketides |
| Class | 2-arylbenzofuran flavonoids |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 2-arylbenzofuran flavonoids |
| Alternative Parents | 2-phenylbenzofurans Phenylmethylamines Benzylamines Aralkylamines Aryl fluorides Heteroaromatic compounds Furans Oxacyclic compounds Dialkylamines Carboximidic acids Organopnictogen compounds Organooxygen compounds Organofluorides Hydrochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 2-arylbenzofuran flavonoid - Phenylbenzofuran - 2-phenylbenzofuran - Benzofuran - Phenylmethylamine - Benzylamine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Carboximidic acid derivative - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety. |
| External Descriptors | Not available |
| Solubility | DMSO : 25 mg/mL (74.68 mM; Need ultrasonic) |
|---|---|
| Sensitivity | Moisture sensitive. |
| Molecular Weight | 334.800 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 334.088 Da |
| Monoisotopic Mass | 334.088 Da |
| Topological Polar Surface Area | 68.300 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 398.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |
| 1. Shi-Hui Lu, Xiao-Na Liang, Xiao-Jin Nong, Ran Chen, Xiu-Xia Li. (2023) A New HPLC-UV Method Using Hydrolyzation with Sodium Hydroxide for Quantitation of Trans-p-Hydroxycinnamic Acid and Total Trans-p-Hydroxycinnamic Acid Esters in the Leaves of Ligustrum robustum. MOLECULES, 28 (14): (5309). [PMID:37513183] [10.3390/molecules28145309] |
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| 5. Nan Xue, Jing Liu, Pengyuan Wang, Chunyan Wang, Sen Li, Hui Zhu, Jiao Yin. (2020) Scalable synthesis of Fe3N nanoparticles within N-doped carbon frameworks as efficient electrocatalysts for oxygen reduction reaction. JOURNAL OF COLLOID AND INTERFACE SCIENCE, [PMID:32711197] [10.1016/j.jcis.2020.07.005] |
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| 10. Chanjuan Yang, Shoukang Xiao, Liyu Chen, Yingwei Li, Kui Shen. (2025) Ambient-condition hydrogenation of renewable levulinic acid to γ-valerolactone over metallic-acidic RuPt/MIL-101 catalyst. CHEMICAL ENGINEERING SCIENCE, [PMID:] [10.1016/j.ces.2025.122404] |
| 11. Cuichuan Zhang, Zhiqiang Lu, Shu-Dong Jiang, Jiasheng Qian. (2023) Fabrication of poly(vinylidene fluoride)-based composite powder coating with enhanced adhesion performance. JOURNAL OF APPLIED POLYMER SCIENCE, 141 (6): (e54918). [PMID:] [10.1002/app.54918] |
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