3-[([3-methyl-4-(3-methylphenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[([3-methyl-4-(3-methylphenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
3-[([3-methyl-4-(3-methylphenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G696-0228 |
| Compound Name: | 3-[([3-methyl-4-(3-methylphenyl)piperazin-1-yl]{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 570.61 |
| Molecular Formula: | C28 H32 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(\NCc1ccc(C)cc1)=N/c1cccc(c1)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9232 |
| logD: | 5.9232 |
| logSw: | -5.3067 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.173 |
| InChI Key: | KEZGRSNNGAQDBN-QFIPXVFZSA-N |