6-(4-benzylpiperidine-1-carbonyl)-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-(4-benzylpiperidine-1-carbonyl)-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
6-(4-benzylpiperidine-1-carbonyl)-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-3022 |
| Compound Name: | 6-(4-benzylpiperidine-1-carbonyl)-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 536.62 |
| Molecular Formula: | C30 H27 F3 N2 O2 S |
| Smiles: | CN1C(/C(=C/c2ccc(cc2)C(F)(F)F)Sc2ccc(cc12)C(N1CCC(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5342 |
| logD: | 6.5342 |
| logSw: | -5.7473 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.4836 |
| InChI Key: | NKDIKBBKNQAPBM-UHFFFAOYSA-N |