4-({[4-(4-acetylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-({[4-(4-acetylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
4-({[4-(4-acetylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-0289 |
| Compound Name: | 4-({[4-(4-acetylphenyl)piperazin-1-yl][(2-phenylethyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 584.6 |
| Molecular Formula: | C28 H30 N4 O3 |
| Salt: | CF3COOH |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(\NCCc1ccccc1)=N/c1ccc(cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2833 |
| logD: | 4.2833 |
| logSw: | -4.0505 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.623 |
| InChI Key: | DDIAWBZWPOTWMN-UHFFFAOYSA-N |