AC1Q4BMR structure

AC1Q4BMR

N-(4-bromophenyl)-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

Also Known As: N-(4-bromophenyl)-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(4-bromophenyl)-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(4-bromophenyl)-2-((4-(4-methoxyphenyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-bromophenyl)-2-[4-(4-methoxyphenyl)-5-(4-methylphenyl)(1,2,4-triazol-3-yl thio)]acetamide

CAS: 861111-97-9
Molecular Formula C24H21BrN4O2S
Molecular Weight 508.05685 g/mol
LogP 5.74462
Topological Polar Surface Area 69.04 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 508.05685
Monoisotopic Mass 508.05685
Heavy Atoms 32
Complexity 1206.4951

Chemical Identifiers

CAS Number 861111-97-9
SMILES CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NC4=CC=C(C=C4)Br

Product Overview

AC1Q4BMR (CAS 861111-97-9), with molecular formula C24H21BrN4O2S and molecular weight 508.05685 g/mol. IUPAC: N-(4-bromophenyl)-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.

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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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