5-benzamido-2-[4-(4-chlorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-benzamido-2-[4-(4-chlorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
5-benzamido-2-[4-(4-chlorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | G889-0199 |
Compound Name: | 5-benzamido-2-[4-(4-chlorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1) |
Molecular Weight: | 549.93 |
Molecular Formula: | C24 H22 Cl N3 O3 |
Salt: | CF3COOH |
Smiles: | C1CN(CCN1c1ccc(cc1)[Cl])c1ccc(cc1C(O)=O)NC(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.1003 |
logD: | 2.8496 |
logSw: | -5.0523 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 58.15 |
InChI Key: | NNSDBFPEXWOXGJ-UHFFFAOYSA-N |