5-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)-2-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)-2-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1)
5-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)-2-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F685-1033 |
| Compound Name: | 5-(4'-carbamoyl[1,4'-bipiperidin]-1'-yl)-2-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 594.59 |
| Molecular Formula: | C26 H32 N4 O5 |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)C(Nc1ccc(cc1C(O)=O)N1CCC(CC1)(C(N)=O)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0061 |
| logD: | 3.0061 |
| logSw: | -3.4617 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 99.172 |
| InChI Key: | MGCCLEKZZHAKOR-UHFFFAOYSA-N |