AC1N590O structure

AC1N590O

[4-(2,3-dimethylphenyl)piperazin-1-yl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone

Also Known As: F6548-3400|5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-8,10,17-triazatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(17),2,4,6,11(16),12,14-heptaene-9-thione|[4-(2,3-dimethylphenyl)piperazin-1-yl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone|(4-(2,3-dimethylphenyl)piperazin-1-yl)(6-thioxo-5,6-dihydrobenzo[4,5]imidazo[1,2-c]quinazolin-3-yl)methanone|[4-(2,3-DIMETHYLPHENYL)PIPERAZINO](6-THIOXO-5,6-DIHYDRO[1,3]BENZIMIDAZO[1,2-C]QUINAZOLIN-3-YL)METHANONE|3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl}benzimidazo[1,2-c]quinazoline-6(5H)-thione

CAS: 688792-47-4
Molecular Formula C27H25N5OS
Molecular Weight 467.17798 g/mol
LogP 5.27753
Topological Polar Surface Area 56.64 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 467.17798
Monoisotopic Mass 467.17798
Heavy Atoms 34
Complexity 1642.3645

Chemical Identifiers

CAS Number 688792-47-4
SMILES CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C5=NC6=CC=CC=C6N5C(=S)N4)C

Product Overview

AC1N590O (CAS 688792-47-4), with molecular formula C27H25N5OS and molecular weight 467.17798 g/mol. IUPAC: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone.

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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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