1-{4-nitro-1-phenyl-3-[(2-phenylhydrazinylidene)methyl]-1H-pyrazol-5-yl}azepane
Chemical Structure Depiction of
1-{4-nitro-1-phenyl-3-[(2-phenylhydrazinylidene)methyl]-1H-pyrazol-5-yl}azepane
1-{4-nitro-1-phenyl-3-[(2-phenylhydrazinylidene)methyl]-1H-pyrazol-5-yl}azepane
Compound characteristics
| Compound ID: | 4872-0094 |
| Compound Name: | 1-{4-nitro-1-phenyl-3-[(2-phenylhydrazinylidene)methyl]-1H-pyrazol-5-yl}azepane |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | C1CCCN(CC1)c1c(c(C=NNc2ccccc2)nn1c1ccccc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8168 |
| logD: | 5.8167 |
| logSw: | -5.8674 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.851 |
| InChI Key: | RQEXMHLFCZDIKZ-UHFFFAOYSA-N |