N-[(3-methoxyphenyl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[(3-methoxyphenyl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-7788 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 358.31 |
| Molecular Formula: | C15 H14 N6 O5 |
| Smiles: | COc1cccc(CNC(c2nc(Cn3cc(cn3)[N+]([O-])=O)no2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.9946 |
| logD: | 0.9946 |
| logSw: | -2.1594 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.022 |
| InChI Key: | BBOMLXREFYOOKV-UHFFFAOYSA-N |