AC1LKB98 structure

AC1LKB98

ethyl 3-[1-(3-chloroanilino)-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl]propanoate

Also Known As: Oprea1_138171|Oprea1_224825|ethyl 3-[1-(3-chloroanilino)-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl]propanoate|ethyl 3-{1-[(3-chlorophenyl)amino]-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl}propanoate|ethyl 3-(1-((3-chlorophenyl)amino)-4-cyano-3-methylbenzo[4,5]imidazo[1,2-a]pyridin-2-yl)propanoate

CAS: 459184-83-9
Molecular Formula C24H21ClN4O2
Molecular Weight 432.1353 g/mol
LogP 5.5603
Topological Polar Surface Area 79.42 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 432.1353
Monoisotopic Mass 432.1353
Heavy Atoms 31
Complexity 1337.1584

Chemical Identifiers

CAS Number 459184-83-9
SMILES CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC(=CC=C4)Cl

Product Overview

AC1LKB98 (CAS 459184-83-9), with molecular formula C24H21ClN4O2 and molecular weight 432.1353 g/mol. IUPAC: ethyl 3-[1-(3-chloroanilino)-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl]propanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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