2-(azepan-1-yl)-5-[(4-cyclohexylbenzene-1-sulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-(azepan-1-yl)-5-[(4-cyclohexylbenzene-1-sulfonyl)amino]benzoic acid
2-(azepan-1-yl)-5-[(4-cyclohexylbenzene-1-sulfonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | F294-0319 |
| Compound Name: | 2-(azepan-1-yl)-5-[(4-cyclohexylbenzene-1-sulfonyl)amino]benzoic acid |
| Molecular Weight: | 570.63 |
| Molecular Formula: | C25 H32 N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | C1CCC(CC1)c1ccc(cc1)S(Nc1ccc(c(c1)C(O)=O)N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6054 |
| logD: | 4.4897 |
| logSw: | -5.8016 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.699 |
| InChI Key: | WUCHGRFILBSOTG-UHFFFAOYSA-N |