3-({[4-(2,5-dimethylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-({[4-(2,5-dimethylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
3-({[4-(2,5-dimethylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G696-5903 |
| Compound Name: | 3-({[4-(2,5-dimethylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 570.61 |
| Molecular Formula: | C28 H32 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(/NCCc1ccccc1)=N/c1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0466 |
| logD: | 6.0466 |
| logSw: | -5.3582 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.495 |
| InChI Key: | SLEAXLITANCAHY-UHFFFAOYSA-N |