N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Chemical Structure Depiction of
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Compound characteristics
| Compound ID: | C312-1641 |
| Compound Name: | N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide |
| Molecular Weight: | 489.56 |
| Molecular Formula: | C25 H26 F3 N3 O2 S |
| Smiles: | CCN1CCCC1CNC(CN1C(/C(=C\c2ccc(cc2)C(F)(F)F)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4014 |
| logD: | 3.4181 |
| logSw: | -4.1781 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.448 |
| InChI Key: | MKYFVEHNUALTMY-LJQANCHMSA-N |