AC1OBOO2 structure

AC1OBOO2

N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide

Also Known As: (E)-N'-(4-(diethylamino)benzylidene)-2-((5-((naphthalen-1-ylmethyl)thio)-1,3,4-thiadiazol-2-yl)thio)acetohydrazide|N'-{(E)-[4-(diethylamino)phenyl]methylidene}-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide|N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide|N-{(1E)-2-[4-(diethylamino)phenyl]-1-azavinyl}-2-[5-(naphthylmethylthio)(1,3,4 -thiadiazol-2-ylthio)]acetamide

CAS: 489463-87-8
Molecular Formula C26H27N5OS3
Molecular Weight 521.13776 g/mol
LogP 6.0722
Topological Polar Surface Area 70.48 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 11
Exact Mass 521.13776
Monoisotopic Mass 521.13776
Heavy Atoms 35
Complexity 1280.4017

Chemical Identifiers

CAS Number 489463-87-8
SMILES CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

Product Overview

AC1OBOO2 (CAS 489463-87-8), with molecular formula C26H27N5OS3 and molecular weight 521.13776 g/mol. IUPAC: N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[5-(naphthalen-1-ylmethylsulfanyl)-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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