N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Compound characteristics
| Compound ID: | K788-2463 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide |
| Molecular Weight: | 570.63 |
| Molecular Formula: | C30 H29 F3 N2 O4 S |
| Smiles: | CCOc1ccc(CCNC(CN2C(/C(=C/c3ccc(cc3)C(F)(F)F)Sc3ccccc23)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 5.2842 |
| logD: | 5.2842 |
| logSw: | -5.1487 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.803 |
| InChI Key: | WBUGFTNMDSUGLQ-UHFFFAOYSA-N |