AC1MG3UJ structure

AC1MG3UJ

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]acetamide

Also Known As: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide|AF-399/41219746|F1312-0023|N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]acetamide|N-(3,4-dimethoxyphenethyl)-2-(3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-benzo[b][1,4]thiazin-2-yl)acetamide|N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)(2H,4H-benzo[e]1, 4-thiazaperhydroin-2-yl)]acetamide

CAS: 458527-29-2
Molecular Formula C21H21F3N2O4S
Molecular Weight 454.1174 g/mol
LogP 3.8844
Topological Polar Surface Area 76.66 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 454.1174
Monoisotopic Mass 454.1174
Heavy Atoms 31
Complexity 981.5826

Chemical Identifiers

CAS Number 458527-29-2
SMILES COC1=C(C=C(C=C1)CCNC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)C(F)(F)F)OC

Product Overview

AC1MG3UJ (CAS 458527-29-2), with molecular formula C21H21F3N2O4S and molecular weight 454.1174 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]acetamide.

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