2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8001-1457 |
| Compound Name: | 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile |
| Molecular Weight: | 426.46 |
| Molecular Formula: | C23 H17 F3 N2 O S |
| Smiles: | Cc1ccc(C(CSc2c(C#N)c(cc(c3ccccc3)n2)C(F)(F)F)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.9369 |
| logD: | 6.9369 |
| logSw: | -5.737 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.746 |
| InChI Key: | SFNDZTQVGMBKMF-UHFFFAOYSA-N |