N-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}glycine
Chemical Structure Depiction of
N-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}glycine
N-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}glycine
Compound characteristics
| Compound ID: | 4748-0786 |
| Compound Name: | N-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}glycine |
| Molecular Weight: | 279.31 |
| Molecular Formula: | C12 H13 N3 O3 S |
| Smiles: | Cc1cc(C)nc(c1C#N)SCC(NCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2452 |
| logD: | -3.6411 |
| logSw: | -1.8263 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.704 |
| InChI Key: | DCDBUEPZMQDOFR-UHFFFAOYSA-N |