3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoic acid
Chemical Structure Depiction of
3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoic acid
3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoic acid
Compound characteristics
| Compound ID: | K783-4975 |
| Compound Name: | 3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoic acid |
| Molecular Weight: | 333.36 |
| Molecular Formula: | C16 H15 N O5 S |
| Smiles: | CC(Nc1cc(ccc1S(c1ccc(C)cc1)(=O)=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4736 |
| logD: | -0.0804 |
| logSw: | -2.8444 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.712 |
| InChI Key: | AUMZIMXACUDOLI-UHFFFAOYSA-N |