4-[({[(4-methylphenyl)methyl]amino}{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-[({[(4-methylphenyl)methyl]amino}{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
4-[({[(4-methylphenyl)methyl]amino}{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-5997 |
| Compound Name: | 4-[({[(4-methylphenyl)methyl]amino}{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 593.6 |
| Molecular Formula: | C26 H33 N5 O4 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(CN\C(=N/c2ccc(cc2)C(O)=O)N2CCN(CC2)CC(N2CCOCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9464 |
| logD: | 1.9464 |
| logSw: | -2.479 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.536 |
| InChI Key: | CMAGAKWKUXOGSI-UHFFFAOYSA-N |