N-[2-(methylsulfanyl)phenyl]-6-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-[2-(methylsulfanyl)phenyl]-6-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyridine-3-carboxamide
N-[2-(methylsulfanyl)phenyl]-6-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | G843-1647 |
| Compound Name: | N-[2-(methylsulfanyl)phenyl]-6-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,6-dihydropyridine-3-carboxamide |
| Molecular Weight: | 418.44 |
| Molecular Formula: | C21 H17 F3 N2 O2 S |
| Smiles: | CSc1ccccc1NC(C1C=CC(N(Cc2ccc(cc2)C(F)(F)F)C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6554 |
| logD: | 3.6438 |
| logSw: | -4.0058 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.143 |
| InChI Key: | RILUTZJRSWYQJE-UHFFFAOYSA-N |