4-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)-2-methoxy-3-nitrophenyl acetate
Chemical Structure Depiction of
4-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)-2-methoxy-3-nitrophenyl acetate
4-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)-2-methoxy-3-nitrophenyl acetate
Compound characteristics
| Compound ID: | 8003-2744 |
| Compound Name: | 4-({2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl)-2-methoxy-3-nitrophenyl acetate |
| Molecular Weight: | 511.24 |
| Molecular Formula: | C18 H15 Br N4 O9 |
| Smiles: | CC(=O)Oc1ccc(/C=N/NC(COc2ccc(cc2[Br])[N+]([O-])=O)=O)c(c1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7455 |
| logD: | 3.7435 |
| logSw: | -4.3199 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 137.643 |
| InChI Key: | MJQZITPADPUTRI-UHFFFAOYSA-N |