5-(4-fluorobenzamido)-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(4-fluorobenzamido)-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
5-(4-fluorobenzamido)-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0655 |
| Compound Name: | 5-(4-fluorobenzamido)-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 551.47 |
| Molecular Formula: | C24 H21 F2 N3 O3 |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCN1c1ccc(cc1)F)c1ccc(cc1C(O)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6687 |
| logD: | 2.4181 |
| logSw: | -4.4362 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.15 |
| InChI Key: | OXMRYWOGOXNMQM-UHFFFAOYSA-N |