bis(4-{[(3-methylphenyl)imino]methyl}phenyl) 2-nitrobenzene-1,4-dicarboxylate
Chemical Structure Depiction of
bis(4-{[(3-methylphenyl)imino]methyl}phenyl) 2-nitrobenzene-1,4-dicarboxylate
bis(4-{[(3-methylphenyl)imino]methyl}phenyl) 2-nitrobenzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | 8003-2084 |
| Compound Name: | bis(4-{[(3-methylphenyl)imino]methyl}phenyl) 2-nitrobenzene-1,4-dicarboxylate |
| Molecular Weight: | 597.63 |
| Molecular Formula: | C36 H27 N3 O6 |
| Smiles: | Cc1cccc(c1)/N=C/c1ccc(cc1)OC(c1ccc(C(=O)Oc2ccc(/C=N/c3cccc(C)c3)cc2)c(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2463 |
| logD: | 7.2446 |
| logSw: | -5.7264 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.329 |
| InChI Key: | ZHQCBPNQMAKADG-UHFFFAOYSA-N |