5-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid
Chemical Structure Depiction of
5-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid
5-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid
Compound characteristics
| Compound ID: | F687-1226 |
| Compound Name: | 5-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C27 H28 F N3 O3 |
| Smiles: | Cc1ccc(CC(Nc2ccc(cc2C(O)=O)N2CCN(CC2)Cc2ccccc2F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.258 |
| logD: | 0.5549 |
| logSw: | -4.1593 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.819 |
| InChI Key: | KQFFNIHYUNUCTI-UHFFFAOYSA-N |