2-bromo-6-({2-[(2-cyanophenoxy)acetyl]hydrazinylidene}methyl)-4-nitrophenyl benzoate
Chemical Structure Depiction of
2-bromo-6-({2-[(2-cyanophenoxy)acetyl]hydrazinylidene}methyl)-4-nitrophenyl benzoate
2-bromo-6-({2-[(2-cyanophenoxy)acetyl]hydrazinylidene}methyl)-4-nitrophenyl benzoate
Compound characteristics
| Compound ID: | 8006-2248 |
| Compound Name: | 2-bromo-6-({2-[(2-cyanophenoxy)acetyl]hydrazinylidene}methyl)-4-nitrophenyl benzoate |
| Molecular Weight: | 523.3 |
| Molecular Formula: | C23 H15 Br N4 O6 |
| Smiles: | C(C(N/N=C/c1cc(cc(c1OC(c1ccccc1)=O)[Br])[N+]([O-])=O)=O)Oc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 4.746 |
| logD: | 4.7393 |
| logSw: | -4.8372 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.915 |
| InChI Key: | KBQYSTHUIPMNNN-UHFFFAOYSA-N |