[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetic acid
[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | 8008-8816 |
| Compound Name: | [(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetic acid |
| Molecular Weight: | 236.29 |
| Molecular Formula: | C11 H12 N2 O2 S |
| Smiles: | Cc1c(C)c(C)nc(c1C#N)SCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8407 |
| logD: | -1.6244 |
| logSw: | -1.7459 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.003 |
| InChI Key: | QPCNBFPZOZJIHO-UHFFFAOYSA-N |