AC1LR1JB structure

AC1LR1JB

1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Also Known As: 1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone|1-(Benzo[d][1,3]dioxol-5-yl)-2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)ethanone|1-(1,3-Benzodioxol-5-YL)-2-((5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-YL)sulfanyl)ethanone|1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone|1-(2H-1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one|1-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-2-[5-(4-chlorophenyl)-4-(4-methylphenyl)( 1,2,4-triazol-3-ylthio)]ethan-1-one|650-679-8

CAS: 477332-79-9
Molecular Formula C24H18ClN3O3S
Molecular Weight 463.07574 g/mol
LogP 5.59982
Topological Polar Surface Area 66.24 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 463.07574
Monoisotopic Mass 463.07574
Heavy Atoms 32
Complexity 1287.0997

Chemical Identifiers

CAS Number 477332-79-9
SMILES CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl

Product Overview

AC1LR1JB (CAS 477332-79-9), with molecular formula C24H18ClN3O3S and molecular weight 463.07574 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone.

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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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