phenyl {[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
phenyl {[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetate
phenyl {[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8013-0420 |
| Compound Name: | phenyl {[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C17 H16 N2 O3 S |
| Smiles: | Cc1cc(COC)c(C#N)c(n1)SCC(=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9747 |
| logD: | 2.9747 |
| logSw: | -3.2565 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.055 |
| InChI Key: | RXTPKFVAMSEKLT-UHFFFAOYSA-N |