5-(4-benzylpiperidin-1-yl)-2-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(4-benzylpiperidin-1-yl)-2-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1)
5-(4-benzylpiperidin-1-yl)-2-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F685-0231 |
| Compound Name: | 5-(4-benzylpiperidin-1-yl)-2-(4-fluorobenzamido)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.52 |
| Molecular Formula: | C26 H25 F N2 O3 |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCC1Cc1ccccc1)c1ccc(c(c1)C(O)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5331 |
| logD: | 1.4169 |
| logSw: | -5.7624 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.221 |
| InChI Key: | XCTVDHFTCKGGAT-UHFFFAOYSA-N |