3-[({[(4-methylphenyl)methyl]amino}{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[({[(4-methylphenyl)methyl]amino}{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
3-[({[(4-methylphenyl)methyl]amino}{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G696-5873 |
| Compound Name: | 3-[({[(4-methylphenyl)methyl]amino}{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 565.59 |
| Molecular Formula: | C25 H33 N5 O3 |
| Salt: | CF3COOH |
| Smiles: | CCCNC(CN1CCN(CC1)C(\NCc1ccc(C)cc1)=N/c1cccc(c1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5274 |
| logD: | 3.5274 |
| logSw: | -3.4177 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.82 |
| InChI Key: | OLOARXXQMWILNE-UHFFFAOYSA-N |