AC1N1UVX structure

AC1N1UVX

2-(4-bromophenyl)-N-(4-chlorophenyl)-6-(4-methoxyphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide

Also Known As: ChemDiv1_022331|Oprea1_673350|HMS650H01|A2649/0112856|SR-01000444065-1|F0784-0246|1-(4-bromophenyl)-N-(4-chlorophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide|2-(4-bromophenyl)-N-(4-chlorophenyl)-6-(4-methoxyphenyl)-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carboxamide|2-(4-bromophenyl)-N-(4-chlorophenyl)-6-(4-methoxyphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide|4-(4-bromophenyl)-N-(4-chlorophenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,3,4a-triazacyclopenta[cd]azulene-2-carboxamide

CAS: 397266-40-9
Molecular Formula C29H24BrClN4O2
Molecular Weight 574.07715 g/mol
LogP 7.4829
Topological Polar Surface Area 60.56 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 5
Exact Mass 574.07715
Monoisotopic Mass 574.07715
Heavy Atoms 37
Complexity 1603.7432

Chemical Identifiers

CAS Number 397266-40-9
SMILES COC1=CC=C(C=C1)C2=C(N3C4=C2CCCCN4C(=N3)C5=CC=C(C=C5)Br)C(=O)NC6=CC=C(C=C6)Cl

Product Overview

AC1N1UVX (CAS 397266-40-9), with molecular formula C29H24BrClN4O2 and molecular weight 574.07715 g/mol. IUPAC: 2-(4-bromophenyl)-N-(4-chlorophenyl)-6-(4-methoxyphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide.

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