3-butanamido-4-[(4-methylphenyl)sulfanyl]benzoic acid
Chemical Structure Depiction of
3-butanamido-4-[(4-methylphenyl)sulfanyl]benzoic acid
3-butanamido-4-[(4-methylphenyl)sulfanyl]benzoic acid
Compound characteristics
| Compound ID: | K783-4971 |
| Compound Name: | 3-butanamido-4-[(4-methylphenyl)sulfanyl]benzoic acid |
| Molecular Weight: | 329.42 |
| Molecular Formula: | C18 H19 N O3 S |
| Smiles: | CCCC(Nc1cc(ccc1Sc1ccc(C)cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8779 |
| logD: | 1.9921 |
| logSw: | -4.2693 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.826 |
| InChI Key: | UKPCWHLPERFARK-UHFFFAOYSA-N |