ethyl 3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxylate
ethyl 3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxylate
Compound characteristics
| Compound ID: | 8018-0006 |
| Compound Name: | ethyl 3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxylate |
| Molecular Weight: | 267.2 |
| Molecular Formula: | C9 H9 N5 O5 |
| Smiles: | CCOC(c1nc(Cn2ccc(n2)[N+]([O-])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2637 |
| logD: | 0.2637 |
| logSw: | -1.5176 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 101.165 |
| InChI Key: | XXDFURHWMUTQIX-UHFFFAOYSA-N |