N-benzyl-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-benzyl-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-6764 |
| Compound Name: | N-benzyl-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 328.28 |
| Molecular Formula: | C14 H12 N6 O4 |
| Smiles: | C(c1ccccc1)NC(c1nc(Cn2cc(cn2)[N+]([O-])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8974 |
| logD: | 0.8973 |
| logSw: | -1.965 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.478 |
| InChI Key: | MGMQHSKVTZKDIK-UHFFFAOYSA-N |