AC1NAXA3 structure

AC1NAXA3

N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide

Also Known As: Oprea1_496472|IFLab1_001752|F0417-0850|N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide|N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-methylbenzamide|N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide

CAS: 392297-52-8
Molecular Formula C18H15FN4O2S2
Molecular Weight 402.06204 g/mol
LogP 3.96872
Topological Polar Surface Area 83.98 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 402.06204
Monoisotopic Mass 402.06204
Heavy Atoms 27
Complexity 960.0053

Chemical Identifiers

CAS Number 392297-52-8
SMILES CC1=CC=CC=C1C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F

Product Overview

AC1NAXA3 (CAS 392297-52-8), with molecular formula C18H15FN4O2S2 and molecular weight 402.06204 g/mol. IUPAC: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide.

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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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