3-[([4-(4-fluorophenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid
Chemical Structure Depiction of
3-[([4-(4-fluorophenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid
3-[([4-(4-fluorophenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid
Compound characteristics
| Compound ID: | G696-0232 |
| Compound Name: | 3-[([4-(4-fluorophenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid |
| Molecular Weight: | 560.55 |
| Molecular Formula: | C26 H27 F N4 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(CN/C(=N/c2cccc(c2)C(O)=O)N2CCN(CC2)c2ccc(cc2)F)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2904 |
| logD: | 5.2904 |
| logSw: | -5.1734 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.955 |
| InChI Key: | WURIPAKZSNROGE-UHFFFAOYSA-N |