5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid
Chemical Structure Depiction of
5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid
5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid
Compound characteristics
| Compound ID: | F290-0320 |
| Compound Name: | 5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C26 H30 N4 O4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)c1ccccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8632 |
| logD: | 3.7476 |
| logSw: | -5.3155 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.219 |
| InChI Key: | ZMDDQZXNOUCFJT-UHFFFAOYSA-N |