2-methylpropyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
2-methylpropyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
2-methylpropyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | 8010-4436 |
| Compound Name: | 2-methylpropyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 331.35 |
| Molecular Formula: | C15 H16 F3 N O2 S |
| Smiles: | CC(C)COC(C1=C(C)Nc2cc(ccc2S1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8931 |
| logD: | 4.3442 |
| logSw: | -4.5528 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.103 |
| InChI Key: | UCMSFGSFHPCQCU-UHFFFAOYSA-N |