2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N'-({4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}methylidene)acetohydrazide
Chemical Structure Depiction of
2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N'-({4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}methylidene)acetohydrazide
2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N'-({4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}methylidene)acetohydrazide
Compound characteristics
Compound ID: | Y508-7074 |
Compound Name: | 2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N'-({4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}methylidene)acetohydrazide |
Molecular Weight: | 530.38 |
Molecular Formula: | C23 H24 Br N5 O5 |
Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCc1cc(/C=N/NC(Cn2c(C)c(c(C)n2)[Br])=O)ccc1OC |
Stereo: | ACHIRAL |
logP: | 3.9672 |
logD: | 3.9671 |
logSw: | -4.3596 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 97.833 |
InChI Key: | VHUALWZTMKEEDP-UHFFFAOYSA-N |