4-[(4-chlorophenyl)sulfanyl]-3-propanamidobenzoic acid
Chemical Structure Depiction of
4-[(4-chlorophenyl)sulfanyl]-3-propanamidobenzoic acid
4-[(4-chlorophenyl)sulfanyl]-3-propanamidobenzoic acid
Compound characteristics
| Compound ID: | K780-0180 |
| Compound Name: | 4-[(4-chlorophenyl)sulfanyl]-3-propanamidobenzoic acid |
| Molecular Weight: | 335.81 |
| Molecular Formula: | C16 H14 Cl N O3 S |
| Smiles: | CCC(Nc1cc(ccc1Sc1ccc(cc1)[Cl])C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5721 |
| logD: | 1.6863 |
| logSw: | -4.479 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.826 |
| InChI Key: | GMIMNABWYADSNC-UHFFFAOYSA-N |