ethyl 2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]propanoate
Chemical Structure Depiction of
ethyl 2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]propanoate
ethyl 2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]propanoate
Compound characteristics
| Compound ID: | Y500-5631 |
| Compound Name: | ethyl 2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]propanoate |
| Molecular Weight: | 264.34 |
| Molecular Formula: | C13 H16 N2 O2 S |
| Smiles: | CCOC(C(C)Sc1c(C#N)cc(C)c(C)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2014 |
| logD: | 3.2014 |
| logSw: | -3.4414 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.372 |
| InChI Key: | DVKWTAFGJUVGES-JTQLQIEISA-N |