N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide
Compound characteristics
| Compound ID: | 5176-4928 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide |
| Molecular Weight: | 454.47 |
| Molecular Formula: | C21 H21 F3 N2 O4 S |
| Smiles: | COc1ccc(CCNC(CC2C(Nc3cc(ccc3S2)C(F)(F)F)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8937 |
| logD: | 2.8935 |
| logSw: | -3.4965 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.418 |
| InChI Key: | XYXNUAHTTLZWPA-SFHVURJKSA-N |