N-[3-(3-methylpiperidin-1-yl)propyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Chemical Structure Depiction of
N-[3-(3-methylpiperidin-1-yl)propyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
N-[3-(3-methylpiperidin-1-yl)propyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Compound characteristics
| Compound ID: | K788-2101 |
| Compound Name: | N-[3-(3-methylpiperidin-1-yl)propyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide |
| Molecular Weight: | 517.61 |
| Molecular Formula: | C27 H30 F3 N3 O2 S |
| Smiles: | CC1CCCN(CCCNC(CN2C(/C(=C/c3ccc(cc3)C(F)(F)F)Sc3ccccc23)=O)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.932 |
| logD: | 2.3024 |
| logSw: | -4.4242 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.299 |
| InChI Key: | PAIZSPIFKXWLNH-IBGZPJMESA-N |