propan-2-yl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
propan-2-yl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate
propan-2-yl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D360-0435 |
| Compound Name: | propan-2-yl {[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C18 H18 N2 O2 S |
| Smiles: | CC(C)OC(CSc1c(C#N)ccc(c2ccc(C)cc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6215 |
| logD: | 4.6215 |
| logSw: | -4.4061 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.608 |
| InChI Key: | BWFQBJYNJCOPTC-UHFFFAOYSA-N |