AC1O4JAL structure

AC1O4JAL

2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide

Also Known As: (Z)-2-((5-phenyl-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide|2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide

CAS: 314072-11-2
Molecular Formula C23H21N5OS2
Molecular Weight 447.11874 g/mol
LogP 4.93672
Topological Polar Surface Area 72.17 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 447.11874
Monoisotopic Mass 447.11874
Heavy Atoms 31
Complexity 1182.707

Chemical Identifiers

CAS Number 314072-11-2
SMILES CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C(/C)\C3=CC=CS3)C4=CC=CC=C4

Product Overview

AC1O4JAL (CAS 314072-11-2), with molecular formula C23H21N5OS2 and molecular weight 447.11874 g/mol. IUPAC: 2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-thiophen-2-ylethylideneamino]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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