N-(4-{5-[2-(4-methoxyphenyl)ethyl]-1,2,4-oxadiazol-3-yl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-(4-{5-[2-(4-methoxyphenyl)ethyl]-1,2,4-oxadiazol-3-yl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
N-(4-{5-[2-(4-methoxyphenyl)ethyl]-1,2,4-oxadiazol-3-yl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | D041-0241 |
| Compound Name: | N-(4-{5-[2-(4-methoxyphenyl)ethyl]-1,2,4-oxadiazol-3-yl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C22 H20 N6 O5 |
| Smiles: | COc1ccc(CCc2nc(c3ccc(cc3)NC(Cn3cc(cn3)[N+]([O-])=O)=O)no2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1163 |
| logD: | 4.1163 |
| logSw: | -4.1646 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.89 |
| InChI Key: | SBUZZQPFMVFZSX-UHFFFAOYSA-N |