3-methyl-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxylic acid
Chemical Structure Depiction of
3-methyl-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxylic acid
3-methyl-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxylic acid
Compound characteristics
| Compound ID: | 8009-7636 |
| Compound Name: | 3-methyl-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxylic acid |
| Molecular Weight: | 332.3 |
| Molecular Formula: | C13 H11 F3 N2 O3 S |
| Smiles: | CN1/C(=N/c2cccc(c2)C(F)(F)F)SC(CC1=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0497 |
| logD: | -0.3844 |
| logSw: | -2.5644 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.493 |
| InChI Key: | YFUCTAGBQAOWKN-VIFPVBQESA-N |