AC1N3IK8 structure

AC1N3IK8

5-chloro-2-methoxy-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Also Known As: IFLab1_001992|Oprea1_702163|F0470-0358|5-chloro-2-methoxy-N-(5-((2-oxo-2-phenylethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|5-chloro-2-methoxy-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide|5-chloro-2-methoxy-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

CAS: 391875-04-0
Molecular Formula C18H14ClN3O3S2
Molecular Weight 419.0165 g/mol
LogP 4.4274
Topological Polar Surface Area 81.18 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 419.0165
Monoisotopic Mass 419.0165
Heavy Atoms 27
Complexity 963.49554

Chemical Identifiers

CAS Number 391875-04-0
SMILES COC1=C(C=C(C=C1)Cl)C(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

Product Overview

AC1N3IK8 (CAS 391875-04-0), with molecular formula C18H14ClN3O3S2 and molecular weight 419.0165 g/mol. IUPAC: 5-chloro-2-methoxy-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide.

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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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