5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid
Chemical Structure Depiction of
5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid
5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid
Compound characteristics
| Compound ID: | F290-0224 |
| Compound Name: | 5-[(4-tert-butylbenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C24 H31 N3 O6 S |
| Smiles: | CCOC(N1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1ccc(cc1)C(C)(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0981 |
| logD: | 2.9825 |
| logSw: | -4.6486 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.228 |
| InChI Key: | DCHAUFFFHKYOAR-UHFFFAOYSA-N |