5-benzamido-2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-benzamido-2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
5-benzamido-2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0454 |
| Compound Name: | 5-benzamido-2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 563.96 |
| Molecular Formula: | C25 H24 Cl N3 O3 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)c1ccc(cc1C(O)=O)NC(c1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6666 |
| logD: | 3.4159 |
| logSw: | -5.6168 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.849 |
| InChI Key: | USVKGVWGNIQRBT-UHFFFAOYSA-N |