2-{[4-chloro-3-(trifluoromethyl)phenyl]imino}-3-methyl-4-oxo-1,3-thiazinane-6-carboxylic acid
Chemical Structure Depiction of
2-{[4-chloro-3-(trifluoromethyl)phenyl]imino}-3-methyl-4-oxo-1,3-thiazinane-6-carboxylic acid
2-{[4-chloro-3-(trifluoromethyl)phenyl]imino}-3-methyl-4-oxo-1,3-thiazinane-6-carboxylic acid
Compound characteristics
| Compound ID: | 8009-8608 |
| Compound Name: | 2-{[4-chloro-3-(trifluoromethyl)phenyl]imino}-3-methyl-4-oxo-1,3-thiazinane-6-carboxylic acid |
| Molecular Weight: | 366.74 |
| Molecular Formula: | C13 H10 Cl F3 N2 O3 S |
| Smiles: | CN1\C(=N/c2ccc(c(c2)C(F)(F)F)[Cl])SC(CC1=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6347 |
| logD: | 0.2006 |
| logSw: | -3.3149 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.493 |
| InChI Key: | OTDZQKKIVGYXEF-VIFPVBQESA-N |