2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carboxylic acid
Chemical Structure Depiction of
2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carboxylic acid
2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | 2187-0780 |
| Compound Name: | 2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carboxylic acid |
| Molecular Weight: | 273.31 |
| Molecular Formula: | C14 H11 N O3 S |
| Smiles: | C(C(c1ccccc1)=O)Sc1c(cccn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.302 |
| logD: | 0.2038 |
| logSw: | -2.6585 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.801 |
| InChI Key: | MJHMABNIGSEYKN-UHFFFAOYSA-N |