methyl (2-{[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetamido)(phenyl)acetate
Chemical Structure Depiction of
methyl (2-{[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetamido)(phenyl)acetate
methyl (2-{[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetamido)(phenyl)acetate
Compound characteristics
| Compound ID: | 8018-6831 |
| Compound Name: | methyl (2-{[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetamido)(phenyl)acetate |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | Cc1cc(COC)c(C#N)c(n1)SCC(NC(C(=O)OC)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8886 |
| logD: | 1.8886 |
| logSw: | -2.5354 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.998 |
| InChI Key: | CYLJDFOOEPFZCS-GOSISDBHSA-N |