5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-(4-methylpiperazin-1-yl)benzoic acid
Chemical Structure Depiction of
5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-(4-methylpiperazin-1-yl)benzoic acid
5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-(4-methylpiperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F290-0043 |
| Compound Name: | 5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-(4-methylpiperazin-1-yl)benzoic acid |
| Molecular Weight: | 431.55 |
| Molecular Formula: | C22 H29 N3 O4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(Nc1ccc(c(c1)C(O)=O)N1CCN(C)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3784 |
| logD: | 4.3784 |
| logSw: | -3.9895 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.924 |
| InChI Key: | INEDHVPXRNYRKB-UHFFFAOYSA-N |