4-({(4-cyclohexylpiperazin-1-yl)[(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-({(4-cyclohexylpiperazin-1-yl)[(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
4-({(4-cyclohexylpiperazin-1-yl)[(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-5762 |
| Compound Name: | 4-({(4-cyclohexylpiperazin-1-yl)[(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 548.61 |
| Molecular Formula: | C26 H34 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(/NCCc1ccccc1)=N/c1ccc(cc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6415 |
| logD: | 4.6415 |
| logSw: | -4.3215 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.629 |
| InChI Key: | SOFSGYKIZQSJBR-UHFFFAOYSA-N |