ethyl [(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetate
ethyl [(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8003-0397 |
| Compound Name: | ethyl [(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 278.33 |
| Molecular Formula: | C13 H14 N2 O3 S |
| Smiles: | CCOC(CSc1c(C#N)cc(C(C)=O)c(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0582 |
| logD: | 2.0582 |
| logSw: | -2.437 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.604 |
| InChI Key: | FBFOMFWBVIXBMA-UHFFFAOYSA-N |