2-bromo-4-nitro-6-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}phenyl benzoate
Chemical Structure Depiction of
2-bromo-4-nitro-6-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}phenyl benzoate
2-bromo-4-nitro-6-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}phenyl benzoate
Compound characteristics
| Compound ID: | P160-0001 |
| Compound Name: | 2-bromo-4-nitro-6-{[2-(pyridine-4-carbonyl)hydrazinylidene]methyl}phenyl benzoate |
| Molecular Weight: | 469.25 |
| Molecular Formula: | C20 H13 Br N4 O5 |
| Smiles: | C(\c1cc(cc(c1OC(c1ccccc1)=O)[Br])[N+]([O-])=O)=N/NC(c1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0426 |
| logD: | 3.5148 |
| logSw: | -4.3071 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.915 |
| InChI Key: | WLPAOOHBXDORRX-UHFFFAOYSA-N |