4-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methoxybenzoyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methoxybenzoyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methoxybenzoyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | F390-0144 |
| Compound Name: | 4-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methoxybenzoyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 493.89 |
| Molecular Formula: | C23 H15 Cl F3 N O4 S |
| Smiles: | COc1ccc(cc1)C(C1=CN(c2ccc(c(c2)C(F)(F)F)[Cl])c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9114 |
| logD: | 4.9114 |
| logSw: | -5.0335 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.961 |
| InChI Key: | BUTAXGAGRYXTRG-UHFFFAOYSA-N |