AC1MJMYC
4-[[2-(3-fluorophenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid
Also Known As: BAS 02239137|AG-690/15441583|SR-01000428765-1|4-[({(2Z)-2-[(3-fluorophenyl)imino]-3-methyl-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid|(Z)-4-(2-((3-fluorophenyl)imino)-3-methyl-4-oxo-1,3-thiazinane-6-carboxamido)benzoic acid|4-[[2-(3-fluorophenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid|4-[({2-[(3-fluorophenyl)imino]-3-methyl-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
| Molecular Formula | C19H16FN3O4S |
|---|---|
| Molecular Weight | 401.08456 g/mol |
| LogP | 3.114 |
| Topological Polar Surface Area | 99.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.08456 |
| Monoisotopic Mass | 401.08456 |
| Heavy Atoms | 28 |
| Complexity | 961.906 |
Chemical Identifiers
| CAS Number | 333327-80-3 |
|---|---|
| SMILES | CN1C(=O)CC(SC1=NC2=CC(=CC=C2)F)C(=O)NC3=CC=C(C=C3)C(=O)O |
Product Overview
AC1MJMYC (CAS 333327-80-3), with molecular formula C19H16FN3O4S and molecular weight 401.08456 g/mol. IUPAC: 4-[[2-(3-fluorophenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid.
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