2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(3-methylbenzene-1-sulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(3-methylbenzene-1-sulfonyl)amino]benzoic acid
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(3-methylbenzene-1-sulfonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | F290-0268 |
| Compound Name: | 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(3-methylbenzene-1-sulfonyl)amino]benzoic acid |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Smiles: | Cc1cccc(c1)S(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)c1cccc(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8533 |
| logD: | 3.7377 |
| logSw: | -5.2477 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.407 |
| InChI Key: | WJPXMWFIYJPCOO-UHFFFAOYSA-N |