4-{[2-methyl-5-(phenylcarbamoyl)benzene-1-sulfonyl]amino}benzoic acid
Chemical Structure Depiction of
4-{[2-methyl-5-(phenylcarbamoyl)benzene-1-sulfonyl]amino}benzoic acid
4-{[2-methyl-5-(phenylcarbamoyl)benzene-1-sulfonyl]amino}benzoic acid
Compound characteristics
| Compound ID: | 0917-0025 |
| Compound Name: | 4-{[2-methyl-5-(phenylcarbamoyl)benzene-1-sulfonyl]amino}benzoic acid |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | Cc1ccc(cc1S(Nc1ccc(cc1)C(O)=O)(=O)=O)C(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9804 |
| logD: | 1.5852 |
| logSw: | -4.0409 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.387 |
| InChI Key: | QMAQAFLAXSBHTF-UHFFFAOYSA-N |