N-[(3-methoxyphenyl)methyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[(3-methoxyphenyl)methyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | 8017-7787 |
Compound Name: | N-[(3-methoxyphenyl)methyl]-3-[(3-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(Cn3ccc(n3)[N+]([O-])=O)no2)=O)c1 |
Stereo: | ACHIRAL |
logP: | 0.8003 |
logD: | 0.8003 |
logSw: | -2.1433 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 112.369 |
InChI Key: | RYPBHFHVTQTBLM-UHFFFAOYSA-N |