benzyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
benzyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
benzyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | 8010-4444 |
| Compound Name: | benzyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 365.37 |
| Molecular Formula: | C18 H14 F3 N O2 S |
| Smiles: | CC1=C(C(=O)OCc2ccccc2)Sc2ccc(cc2N1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.2134 |
| logD: | 4.8325 |
| logSw: | -5.2616 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.832 |
| InChI Key: | IPYHHPHWASIDHV-UHFFFAOYSA-N |