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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items TC-A 2317 hydrochloride - ≥98%(HPLC) , CAS No.1245907-03-2
Synonyms
TC-A 2317 (hydrochloride) | J-005099 | 2-[(5-Hydroxy-1,5-dimethylhexyl)amino]-4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-3-pyridinecarbonitrilehydrochloride | VZB90703 | HY-103266 | TC-A2317 hydrochloride | 2-[(6-hydroxy-6-methylheptan-2-yl)amino]-4-met
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Why this grade ≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
TC-A 2317 (hydrochloride) | J-005099 | 2-[(5-Hydroxy-1, 5-dimethylhexyl)amino]-4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-3-pyridinecarbonitrilehydrochloride | VZB90703 | HY-103266 | TC-A2317 hydrochloride | 2-[(6-hydroxy-6-methylheptan-2-yl)amino]-4-met
Especificaciones y pureza
≥98%(HPLC)
Mecanismos bioquímicos y fisiológicos
Potent Aurora kinase A inhibitor (Ki= 1.2 nM compared to 101 nM for inhibition of Aurora kinase B). Selective over 60 other kinases (IC50values > 1000 nM). Exhibits good cell permeability and antitumor activity.
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
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Nombres e identificadores Sonrisas canónicas CC1=CC(=NC(=C1C#N)NC(C)CCCC(C)(C)O)NC2=NNC(=C2)C.Cl IUPAC Name 2-[(6-hydroxy-6-methylheptan-2-yl)amino]-4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridine-3-carbonitrile;hydrochloride InChIKey DXVATYHPJJPMIN-UHFFFAOYSA-N INCHI 1S/C19H28N6O.ClH/c1-12-9-16(22-17-10-14(3)24-25-17)23-18(15(12)11-20)21-13(2)7-6-8-19(4,5)26;/h9-10,13,26H,6-8H2,1-5H3,(H3,21,22,23,24,25);1H Isómeros SMILES CC1=CC(=NC(=C1C#N)NC(C)CCCC(C)(C)O)NC2=NNC(=C2)C.Cl PubChem CID 46911725 Peso molecular 392.93
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 Kingdom Organic compounds Superclass Organoheterocyclic compounds Clase Pyridines and derivatives Subclass 3-pyridinecarbonitriles Intermediate Tree Nodes Not available Direct Parent 3-pyridinecarbonitriles Alternative Parents Secondary alkylarylamines Methylpyridines Aminopyridines and derivatives Imidolactams Tertiary alcohols Pyrazoles Heteroaromatic compounds Nitriles Azacyclic compounds Hydrochlorides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents 3-pyridinecarbonitrile - Aminopyridine - Methylpyridine - Secondary aliphatic/aromatic amine - Imidolactam - Azole - Pyrazole - Heteroaromatic compound - Tertiary alcohol - Carbonitrile - Nitrile - Secondary amine - Azacycle - Cyanide - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Hydrochloride - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as 3-pyridinecarbonitriles. These are organic compounds containing a pyridine ring substituted at the 3-position by a carbonitrile group. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Solvent:DMSO, Max Conc. mg/mL: 39.29, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 19.65, Max Conc. mM: 50 Peso molecular 392.900 g/mol XLogP3 Hydrogen Bond Donor Count 5 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 8 Exact Mass 392.209 Da Monoisotopic Mass 392.209 Da Topological Polar Surface Area 110.000 Ų Heavy Atom Count 27 Formal Charge 0 Complexity 490.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 2
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