3-[(3,4-dimethoxybenzene-1-sulfonyl)amino]-4-(4-ethylpiperazin-1-yl)benzoic acid
Chemical Structure Depiction of
3-[(3,4-dimethoxybenzene-1-sulfonyl)amino]-4-(4-ethylpiperazin-1-yl)benzoic acid
3-[(3,4-dimethoxybenzene-1-sulfonyl)amino]-4-(4-ethylpiperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F292-0127 |
| Compound Name: | 3-[(3,4-dimethoxybenzene-1-sulfonyl)amino]-4-(4-ethylpiperazin-1-yl)benzoic acid |
| Molecular Weight: | 563.55 |
| Molecular Formula: | C21 H27 N3 O6 S |
| Salt: | CF3COOH |
| Smiles: | CCN1CCN(CC1)c1ccc(cc1NS(c1ccc(c(c1)OC)OC)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6282 |
| logD: | 2.6282 |
| logSw: | -3.0178 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.548 |
| InChI Key: | UOXXWSSROQCDEW-UHFFFAOYSA-N |