4-([1,4'-bipiperidin]-1'-yl)-3-[(4-methoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-([1,4'-bipiperidin]-1'-yl)-3-[(4-methoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
4-([1,4'-bipiperidin]-1'-yl)-3-[(4-methoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F295-0598 |
| Compound Name: | 4-([1,4'-bipiperidin]-1'-yl)-3-[(4-methoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 587.61 |
| Molecular Formula: | C24 H31 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)S(Nc1cc(ccc1N1CCC(CC1)N1CCCCC1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2862 |
| logD: | 4.2862 |
| logSw: | -4.081 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.387 |
| InChI Key: | KCIXIXSUENRDME-UHFFFAOYSA-N |