2-[4-(2-chlorophenyl)piperazin-1-yl]-5-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-[4-(2-chlorophenyl)piperazin-1-yl]-5-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1)
2-[4-(2-chlorophenyl)piperazin-1-yl]-5-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0106 |
| Compound Name: | 2-[4-(2-chlorophenyl)piperazin-1-yl]-5-(4-methoxybenzamido)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 579.96 |
| Molecular Formula: | C25 H24 Cl N3 O4 |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)C(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.146 |
| logD: | 2.8954 |
| logSw: | -5.1197 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.393 |
| InChI Key: | VXVPADXGOHNDLG-UHFFFAOYSA-N |