AC1NKB5N structure

AC1NKB5N

N-[3-[(4-fluorophenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenoxypropanamide

Also Known As: (Z)-N-(3-(4-fluorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-phenoxypropanamide|N-[(2E)-3-(4-fluorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenoxypropanamide|N-[3-[(4-fluorophenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenoxypropanamide

CAS: 1024809-72-0
Molecular Formula C21H21FN2O4S2
Molecular Weight 448.09268 g/mol
LogP 2.8902
Topological Polar Surface Area 76.04 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 448.09268
Monoisotopic Mass 448.09268
Heavy Atoms 30
Complexity 1058.1737

Chemical Identifiers

CAS Number 1024809-72-0
SMILES CC(C(=O)N=C1N(C2CS(=O)(=O)CC2S1)CC3=CC=C(C=C3)F)OC4=CC=CC=C4

Product Overview

AC1NKB5N (CAS 1024809-72-0), with molecular formula C21H21FN2O4S2 and molecular weight 448.09268 g/mol. IUPAC: N-[3-[(4-fluorophenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenoxypropanamide.

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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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