2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole
2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | Y500-4008 |
| Compound Name: | 2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole |
| Molecular Weight: | 285.26 |
| Molecular Formula: | C13 H11 N5 O3 |
| Smiles: | Cc1c(cn(Cc2nnc(c3ccccc3)o2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4427 |
| logD: | 1.4427 |
| logSw: | -1.7277 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 78.359 |
| InChI Key: | QPDMEPAKWWEDGF-UHFFFAOYSA-N |