AC1M76AN structure

AC1M76AN

(E)-3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbonyl)prop-2-enenitrile

Also Known As: (E)-3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbonyl)prop-2-enenitrile|3-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-{2,5,7-triazatricyclo[6.4.0.0,2,6]dodeca-1(8),6,9,11-tetraene-5-carbonyl}prop-2-enenitrile

CAS: 735337-40-3
Molecular Formula C25H20BrN5O
Molecular Weight 485.0851 g/mol
LogP 5.16012
Topological Polar Surface Area 66.85 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 485.0851
Monoisotopic Mass 485.0851
Heavy Atoms 32
Complexity 1435.7638

Chemical Identifiers

CAS Number 735337-40-3
SMILES CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)/C=C(\C#N)/C(=O)N3CCN4C3=NC5=CC=CC=C54

Product Overview

AC1M76AN (CAS 735337-40-3), with molecular formula C25H20BrN5O and molecular weight 485.0851 g/mol. IUPAC: (E)-3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbonyl)prop-2-enenitrile.

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