3-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate
Chemical Structure Depiction of
3-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate
3-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate
Compound characteristics
| Compound ID: | 8005-0708 |
| Compound Name: | 3-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate |
| Molecular Weight: | 516.28 |
| Molecular Formula: | C22 H15 Br F N3 O6 |
| Smiles: | C(C(N/N=C/c1cccc(c1)OC(c1cccc(c1)F)=O)=O)Oc1ccc(cc1[Br])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7411 |
| logD: | 4.741 |
| logSw: | -4.9273 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.686 |
| InChI Key: | DKBCKNJQXDKQSJ-UHFFFAOYSA-N |