3-bromo-N'-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]benzohydrazide
Chemical Structure Depiction of
3-bromo-N'-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]benzohydrazide
3-bromo-N'-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]benzohydrazide
Compound characteristics
Compound ID: | Y508-6524 |
Compound Name: | 3-bromo-N'-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]benzohydrazide |
Molecular Weight: | 396.2 |
Molecular Formula: | C14 H14 Br N5 O4 |
Smiles: | Cc1c(c(C)n(CC(NNC(c2cccc(c2)[Br])=O)=O)n1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 1.2583 |
logD: | 1.2294 |
logSw: | -2.417 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 98.554 |
InChI Key: | AYSDDVQIAHZWSG-UHFFFAOYSA-N |