4-{[(4-cyclohexylpiperazin-1-yl){[(4-methylphenyl)methyl]amino}methylidene]amino}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-{[(4-cyclohexylpiperazin-1-yl){[(4-methylphenyl)methyl]amino}methylidene]amino}benzoic acid--trifluoroacetic acid (1/1)
4-{[(4-cyclohexylpiperazin-1-yl){[(4-methylphenyl)methyl]amino}methylidene]amino}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-5761 |
| Compound Name: | 4-{[(4-cyclohexylpiperazin-1-yl){[(4-methylphenyl)methyl]amino}methylidene]amino}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 548.61 |
| Molecular Formula: | C26 H34 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(CN\C(=N/c2ccc(cc2)C(O)=O)N2CCN(CC2)C2CCCCC2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8926 |
| logD: | 4.8926 |
| logSw: | -4.2997 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.788 |
| InChI Key: | CRGPOCDXVSIJEE-UHFFFAOYSA-N |