2-{[(pyridin-2-yl)sulfanyl]methyl}benzoic acid
Chemical Structure Depiction of
2-{[(pyridin-2-yl)sulfanyl]methyl}benzoic acid
2-{[(pyridin-2-yl)sulfanyl]methyl}benzoic acid
Compound characteristics
| Compound ID: | 8016-1876 |
| Compound Name: | 2-{[(pyridin-2-yl)sulfanyl]methyl}benzoic acid |
| Molecular Weight: | 245.3 |
| Molecular Formula: | C13 H11 N O2 S |
| Smiles: | C(c1ccccc1C(O)=O)Sc1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.8904 |
| logD: | -0.8416 |
| logSw: | -3.3323 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.784 |
| InChI Key: | PNHWUGPIUDBHHQ-UHFFFAOYSA-N |