2-methylpropyl {[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
2-methylpropyl {[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetate
2-methylpropyl {[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D360-0564 |
| Compound Name: | 2-methylpropyl {[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 360.86 |
| Molecular Formula: | C18 H17 Cl N2 O2 S |
| Smiles: | CC(C)COC(CSc1c(C#N)ccc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4321 |
| logD: | 5.4321 |
| logSw: | -5.9068 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.305 |
| InChI Key: | ZMVMDCQWPUWRAR-UHFFFAOYSA-N |