N-benzyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide
N-benzyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D360-0521 |
| Compound Name: | N-benzyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 393.89 |
| Molecular Formula: | C21 H16 Cl N3 O S |
| Smiles: | C(c1ccccc1)NC(CSc1c(C#N)ccc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9854 |
| logD: | 4.9854 |
| logSw: | -5.2652 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | XWLDVEQGPRRUCU-UHFFFAOYSA-N |