2-{[(4-chlorophenyl)methyl]sulfanyl}-N-(2-cyanophenyl)acetamide
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-N-(2-cyanophenyl)acetamide
2-{[(4-chlorophenyl)methyl]sulfanyl}-N-(2-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | Y031-3562 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-N-(2-cyanophenyl)acetamide |
| Molecular Weight: | 316.81 |
| Molecular Formula: | C16 H13 Cl N2 O S |
| Smiles: | C(C(Nc1ccccc1C#N)=O)SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6325 |
| logD: | 3.6238 |
| logSw: | -4.2658 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.475 |
| InChI Key: | FYRPJMUGIRJOMJ-UHFFFAOYSA-N |