N-(2-cyanophenyl)-3-[(4-methylphenyl)sulfanyl]propanamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-3-[(4-methylphenyl)sulfanyl]propanamide
N-(2-cyanophenyl)-3-[(4-methylphenyl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | Y031-3580 |
| Compound Name: | N-(2-cyanophenyl)-3-[(4-methylphenyl)sulfanyl]propanamide |
| Molecular Weight: | 296.39 |
| Molecular Formula: | C17 H16 N2 O S |
| Smiles: | Cc1ccc(cc1)SCCC(Nc1ccccc1C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6028 |
| logD: | 3.599 |
| logSw: | -3.7849 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.475 |
| InChI Key: | HDRUZPWURBWWCX-UHFFFAOYSA-N |