AC1OBS8R structure

AC1OBS8R

N-[(E)-(2-bromophenyl)methylideneamino]-2-[[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide

Also Known As: N'-[(E)-(2-bromophenyl)methylidene]-2-({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide|(E)-N'-(2-bromobenzylidene)-2-((5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)acetohydrazide|N-[(1E)-2-(2-bromophenyl)-1-azavinyl]-2-{5-[(4-methylphenyl)methylthio](1,3,4- thiadiazol-2-ylthio)}acetamide|N-[(E)-(2-bromophenyl)methylideneamino]-2-[[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide

CAS: 488100-99-8
Molecular Formula C19H17BrN4OS3
Molecular Weight 491.9748 g/mol
LogP 5.14372
Topological Polar Surface Area 67.24 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 491.9748
Monoisotopic Mass 491.9748
Heavy Atoms 28
Complexity 959.8224

Chemical Identifiers

CAS Number 488100-99-8
SMILES CC1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)N/N=C/C3=CC=CC=C3Br

Product Overview

AC1OBS8R (CAS 488100-99-8), with molecular formula C19H17BrN4OS3 and molecular weight 491.9748 g/mol. IUPAC: N-[(E)-(2-bromophenyl)methylideneamino]-2-[[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-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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