N-[2-(methylsulfanyl)phenyl]-2-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-[2-(methylsulfanyl)phenyl]-2-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
N-[2-(methylsulfanyl)phenyl]-2-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | G842-1404 |
| Compound Name: | N-[2-(methylsulfanyl)phenyl]-2-oxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide |
| Molecular Weight: | 418.44 |
| Molecular Formula: | C21 H17 F3 N2 O2 S |
| Smiles: | CSc1ccccc1NC(C1=CC=CN(Cc2ccc(cc2)C(F)(F)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9716 |
| logD: | 3.9221 |
| logSw: | -4.1509 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.346 |
| InChI Key: | QFTWFPOHARCAPG-UHFFFAOYSA-N |