N-tert-butyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-tert-butyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide
N-tert-butyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D360-0495 |
| Compound Name: | N-tert-butyl-2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 359.88 |
| Molecular Formula: | C18 H18 Cl N3 O S |
| Smiles: | CC(C)(C)NC(CSc1c(C#N)ccc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7144 |
| logD: | 4.7144 |
| logSw: | -4.8151 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.066 |
| InChI Key: | CRBBPTRANGMEBT-UHFFFAOYSA-N |