methyl {[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl}acetate
methyl {[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D360-0620 |
| Compound Name: | methyl {[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 314.36 |
| Molecular Formula: | C16 H14 N2 O3 S |
| Smiles: | COC(CSc1c(C#N)ccc(c2ccc(cc2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3117 |
| logD: | 3.3117 |
| logSw: | -3.5873 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.893 |
| InChI Key: | VTDPYTZQMRKDCK-UHFFFAOYSA-N |