5-(azepan-1-yl)-2-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid
Chemical Structure Depiction of
5-(azepan-1-yl)-2-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid
5-(azepan-1-yl)-2-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid
Compound characteristics
| Compound ID: | F686-0819 |
| Compound Name: | 5-(azepan-1-yl)-2-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C23 H30 N2 O4 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(Nc1ccc(cc1C(O)=O)N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5668 |
| logD: | 1.682 |
| logSw: | -5.0671 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.382 |
| InChI Key: | AJSPRLZISXRURI-UHFFFAOYSA-N |