4-(phenylsulfanyl)-3-propanamidobenzoic acid
Chemical Structure Depiction of
4-(phenylsulfanyl)-3-propanamidobenzoic acid
4-(phenylsulfanyl)-3-propanamidobenzoic acid
Compound characteristics
| Compound ID: | K780-0429 |
| Compound Name: | 4-(phenylsulfanyl)-3-propanamidobenzoic acid |
| Molecular Weight: | 301.36 |
| Molecular Formula: | C16 H15 N O3 S |
| Smiles: | CCC(Nc1cc(ccc1Sc1ccccc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7923 |
| logD: | 0.9065 |
| logSw: | -3.9288 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.826 |
| InChI Key: | OCWKDUWOIKWGIV-UHFFFAOYSA-N |