2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-2-(1,4-dimethyl-1H-pyrazol-3-yl)ethenyl]-5-phenyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-2-(1,4-dimethyl-1H-pyrazol-3-yl)ethenyl]-5-phenyl-1,3,4-oxadiazole
2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-2-(1,4-dimethyl-1H-pyrazol-3-yl)ethenyl]-5-phenyl-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | Y508-4690 |
| Compound Name: | 2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-2-(1,4-dimethyl-1H-pyrazol-3-yl)ethenyl]-5-phenyl-1,3,4-oxadiazole |
| Molecular Weight: | 405.41 |
| Molecular Formula: | C20 H19 N7 O3 |
| Smiles: | Cc1cn(C)nc1\C=C(/c1nnc(c2ccccc2)o1)n1c(C)c(c(C)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8809 |
| logD: | 2.8809 |
| logSw: | -3.1099 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 92.408 |
| InChI Key: | WNBULSGFJIUKRF-UHFFFAOYSA-N |