2-(3-methylbenzamido)-5-(piperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(3-methylbenzamido)-5-(piperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
2-(3-methylbenzamido)-5-(piperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F685-0425 |
| Compound Name: | 2-(3-methylbenzamido)-5-(piperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 452.43 |
| Molecular Formula: | C20 H22 N2 O3 |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1)C(Nc1ccc(cc1C(O)=O)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9043 |
| logD: | -0.212 |
| logSw: | -3.8468 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.492 |
| InChI Key: | KBQAMCJBAAYLTB-UHFFFAOYSA-N |