3-acetamido-4-[(2,4-dimethylphenyl)sulfanyl]benzoic acid
Chemical Structure Depiction of
3-acetamido-4-[(2,4-dimethylphenyl)sulfanyl]benzoic acid
3-acetamido-4-[(2,4-dimethylphenyl)sulfanyl]benzoic acid
Compound characteristics
| Compound ID: | K780-0323 |
| Compound Name: | 3-acetamido-4-[(2,4-dimethylphenyl)sulfanyl]benzoic acid |
| Molecular Weight: | 315.39 |
| Molecular Formula: | C17 H17 N O3 S |
| Smiles: | CC(Nc1cc(ccc1Sc1ccc(C)cc1C)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3642 |
| logD: | 1.4784 |
| logSw: | -4.1716 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.939 |
| InChI Key: | QYJHHWOMDALJEP-UHFFFAOYSA-N |