5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-1222 |
| Compound Name: | 5-(2-chlorobenzamido)-2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 584.04 |
| Molecular Formula: | C26 H32 Cl N3 O3 |
| Salt: | CF3COOH |
| Smiles: | C1CCN(CC1)CCC1CCN(CC1)c1ccc(cc1C(O)=O)NC(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3719 |
| logD: | 5.3719 |
| logSw: | -5.4362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.6 |
| InChI Key: | ITZCRLBWTXLUCR-UHFFFAOYSA-N |