AC1N2HCF structure

AC1N2HCF

1-(4-benzylpiperazin-1-yl)-2-[(2-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile

Also Known As: 1-(4-benzylpiperazin-1-yl)-2-(2-chlorobenzyl)-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile|1-(4-benzylpiperazin-1-yl)-2-(2-chlorobenzyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile|1-(4-benzylpiperazin-1-yl)-2-[(2-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile|3-[(2-chlorophenyl)methyl]-2-methyl-4-[4-benzylpiperazinyl]-5-hydropyridino[1, 2-a]benzimidazolecarbonitrile

CAS: 861111-47-9
Molecular Formula C31H28ClN5
Molecular Weight 505.20334 g/mol
LogP 6.234
Topological Polar Surface Area 47.57 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 505.20334
Monoisotopic Mass 505.20334
Heavy Atoms 37
Complexity 1625.1255

Chemical Identifiers

CAS Number 861111-47-9
SMILES CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=CC=C4Cl)N5CCN(CC5)CC6=CC=CC=C6)C#N

Product Overview

AC1N2HCF (CAS 861111-47-9), with molecular formula C31H28ClN5 and molecular weight 505.20334 g/mol. IUPAC: 1-(4-benzylpiperazin-1-yl)-2-[(2-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile.

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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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