3-{[{[(4-methylphenyl)methyl]amino}(4-propylpiperazin-1-yl)methylidene]amino}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-{[{[(4-methylphenyl)methyl]amino}(4-propylpiperazin-1-yl)methylidene]amino}benzoic acid--trifluoroacetic acid (1/1)
3-{[{[(4-methylphenyl)methyl]amino}(4-propylpiperazin-1-yl)methylidene]amino}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G696-5845 |
| Compound Name: | 3-{[{[(4-methylphenyl)methyl]amino}(4-propylpiperazin-1-yl)methylidene]amino}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 508.54 |
| Molecular Formula: | C23 H30 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | CCCN1CCN(CC1)C(/NCc1ccc(C)cc1)=N/c1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1347 |
| logD: | 4.1347 |
| logSw: | -3.8916 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.485 |
| InChI Key: | OKAIDFULUDEUSP-UHFFFAOYSA-N |