methyl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate
methyl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D360-0431 |
| Compound Name: | methyl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 298.36 |
| Molecular Formula: | C16 H14 N2 O2 S |
| Smiles: | Cc1ccc(cc1)c1ccc(C#N)c(n1)SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7527 |
| logD: | 3.7527 |
| logSw: | -3.9806 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.349 |
| InChI Key: | VGWUBMNLTDYCNJ-UHFFFAOYSA-N |