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Moligand™, ≥99% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Alogliptin is a potent, selective inhibitor of DPP-4 with IC50 of <10 nM, exhibits greater than 10,000-fold selectivity over DPP-8 and DPP-9.
[1]. Comprehensive hazard, handling, storage, and regulatory compliance document. Lot-specific quality data. Enter your lot number to retrieve the exact COA. Full quality attributes and acceptance criteria for this grade. Taxonomy Tree Find and download the COA for your product by matching the lot number on the packaging. 8 results found Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.Names and Identifiers
Pubchem Sid 488197519 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488197519 Canonical Smiles CN1C(=O)C=C(N(C1=O)CC2=CC=CC=C2C#N)N3CCCC(C3)N IUPAC Name 2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile InChIKey ZSBOMTDTBDDKMP-OAHLLOKOSA-N INCHI 1S/C18H21N5O2/c1-21-17(24)9-16(22-8-4-7-15(20)12-22)23(18(21)25)11-14-6-3-2-5-13(14)10-19/h2-3,5-6,9,15H,4,7-8,11-12,20H2,1H3/t15-/m1/s1 Isomeric SMILES CN1C(=O)C=C(N(C1=O)CC2=CC=CC=C2C#N)N3CCC[C@H](C3)N Molecular Weight 339.39 Reaxy-Rn 12412967 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=12412967&ln= Documentation
📋 Safety Data Sheet (SDS)
✅ Certificate of Analysis (COA)
🔬 Specification Sheet
Advanced Data
Taxonomic Classification
Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Benzonitriles Intermediate Tree Nodes Not available Direct Parent Benzonitriles Alternative Parents Dialkylarylamines Pyrimidones Aminopiperidines Aminopyrimidines and derivatives Hydropyrimidines Vinylogous amides Heteroaromatic compounds Ureas Lactams Azacyclic compounds Nitriles Hydrocarbon derivatives Monoalkylamines Organic oxides Organooxygen compounds Organopnictogen compounds Molecular Framework Aromatic heteromonocyclic compounds Substituents Benzonitrile - Dialkylarylamine - 3-aminopiperidine - Aminopyrimidine - Pyrimidone - Hydropyrimidine - Piperidine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Lactam - Urea - Azacycle - Nitrile - Carbonitrile - Organoheterocyclic compound - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent. External Descriptors piperidines - pyrimidines - primary amino compound - nitrile 3D Structure
Associated Targets(Human)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs) Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Associated Targets(non-human)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Lot Number Certificate Type Date Item
C23031326Certificate of Analysis Dec 06, 2024 A126201
H2130019Certificate of Analysis Jun 09, 2023 A126201
H2130020Certificate of Analysis Jun 09, 2023 A126201
H2130022Certificate of Analysis Jun 09, 2023 A126201
H2130023Certificate of Analysis Jun 09, 2023 A126201
C23031228Certificate of Analysis Mar 31, 2023 A126201
C23031227Certificate of Analysis Mar 31, 2023 A126201
F1927010Certificate of Analysis Feb 07, 2023 A126201 Chemical and Physical Properties
Solubility 25°C: DMSO 68 mg/mL; Water 2mg/m L; Ethanol <1 mg/mL Molecular Weight 339.400 g/mol XLogP3 0.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 3 Exact Mass 339.17 Da Monoisotopic Mass 339.17 Da Topological Polar Surface Area 93.700 Ų Heavy Atom Count 25 Formal Charge 0 Complexity 622.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 1 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 1 Citations of This Product
References
1. Jinsheng Lin, Feifei Chen, Chaohua Bao, Jian Ma, Dan Li, Lewei Zheng, Wenquan Zhu, Wenbin Chen, Xiaoming Liu. (2021) Investigation of an artificial solution degradant of linagliptin: An undesired linagliptin urea derivative generates in sample preparation of linagliptin tablet treated by sonication in acetonitrile containing diluent. JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS, [PMID:34954487] [10.1016/j.jpba.2021.114540] Solution Calculators
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