4-{[2-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazinylidene]methyl}-2-ethoxyphenyl 3-nitrobenzoate
Chemical Structure Depiction of
4-{[2-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazinylidene]methyl}-2-ethoxyphenyl 3-nitrobenzoate
4-{[2-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazinylidene]methyl}-2-ethoxyphenyl 3-nitrobenzoate
Compound characteristics
| Compound ID: | 3229-0565 |
| Compound Name: | 4-{[2-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazinylidene]methyl}-2-ethoxyphenyl 3-nitrobenzoate |
| Molecular Weight: | 590.6 |
| Molecular Formula: | C31 H26 N8 O5 |
| Smiles: | CCOc1cc(/C=N/Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)ccc1OC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2434 |
| logD: | 7.2431 |
| logSw: | -5.7272 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 133.525 |
| InChI Key: | DNAVJZNFCVCWCD-UHFFFAOYSA-N |