2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]propanoic acid
Chemical Structure Depiction of
2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]propanoic acid
2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]propanoic acid
Compound characteristics
| Compound ID: | 8015-0663 |
| Compound Name: | 2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]propanoic acid |
| Molecular Weight: | 270.73 |
| Molecular Formula: | C11 H11 Cl N2 O2 S |
| Smiles: | CC(C(O)=O)Sc1c(C#N)c(C)c(c(C)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6212 |
| logD: | -0.6064 |
| logSw: | -3.2466 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.027 |
| InChI Key: | WSTMMZAZOHLFLK-ZETCQYMHSA-N |