5-[(benzenesulfonyl)amino]-2-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(benzenesulfonyl)amino]-2-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)benzoic acid--trifluoroacetic acid (1/1)
5-[(benzenesulfonyl)amino]-2-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0181 |
| Compound Name: | 5-[(benzenesulfonyl)amino]-2-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 600.61 |
| Molecular Formula: | C24 H30 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | C1CCN(CC1)C1(CCN(CC1)c1ccc(cc1C(O)=O)NS(c1ccccc1)(=O)=O)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0714 |
| logD: | 3.0714 |
| logSw: | -3.6407 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.583 |
| InChI Key: | MSIMTMMECISHKA-UHFFFAOYSA-N |