5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)benzoic acid
Chemical Structure Depiction of
5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)benzoic acid
5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F290-0132 |
| Compound Name: | 5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)benzoic acid |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Smiles: | CCN1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1ccc(C)cc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.808 |
| logD: | 3.808 |
| logSw: | -3.7079 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.984 |
| InChI Key: | UFWAUMXRUVTZDH-UHFFFAOYSA-N |