AC1M16WQ structure

AC1M16WQ

N-(2-chlorophenyl)-2-(3,4-dichlorophenyl)-6-(4-ethylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide

Also Known As: N-(2-chlorophenyl)-4-(3,4-dichlorophenyl)-1-(4-ethylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

CAS: 714944-02-2
Molecular Formula C31H26Cl3N3O
Molecular Weight 561.11414 g/mol
LogP 9.186
Topological Polar Surface Area 38.44 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
Rotatable Bonds 5
Exact Mass 561.11414
Monoisotopic Mass 561.11414
Heavy Atoms 38
Complexity 1681.3412

Chemical Identifiers

CAS Number 714944-02-2
SMILES CCC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC(=C(C=C5)Cl)Cl)C(=O)NC6=CC=CC=C6Cl

Product Overview

AC1M16WQ (CAS 714944-02-2), with molecular formula C31H26Cl3N3O and molecular weight 561.11414 g/mol. IUPAC: N-(2-chlorophenyl)-2-(3,4-dichlorophenyl)-6-(4-ethylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide.

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