4-[([4-(3-chlorophenyl)piperazin-1-yl]{[(3-methoxyphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-[([4-(3-chlorophenyl)piperazin-1-yl]{[(3-methoxyphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
4-[([4-(3-chlorophenyl)piperazin-1-yl]{[(3-methoxyphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-0368 |
| Compound Name: | 4-[([4-(3-chlorophenyl)piperazin-1-yl]{[(3-methoxyphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 593 |
| Molecular Formula: | C26 H27 Cl N4 O3 |
| Salt: | CF3COOH |
| Smiles: | COc1cccc(CN\C(=N/c2ccc(cc2)C(O)=O)N2CCN(CC2)c2cccc(c2)[Cl])c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1283 |
| logD: | 5.1283 |
| logSw: | -5.3063 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.499 |
| InChI Key: | LUOLYMPQNHMAOB-UHFFFAOYSA-N |