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Moligand™, 10mM in DMSO Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -80°C Ships Dry ice packs + Cold packs 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 Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.Nombres e identificadores
Sonrisas canónicas 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 Isómeros SMILES CN1C(=O)C=C(N(C1=O)CC2=CC=CC=C2C#N)N3CCC[C@H](C3)N Peso molecular 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 Clase 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 Descripción 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 Estructura 3D
Objetivos asociados (humanos)
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 Objetivos asociados (no humanos)
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 Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
Propiedades químicas y físicas
Peso molecular 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
Referencias
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] Calculadoras de soluciones
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