N-{4-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]phenyl}-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-{4-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]phenyl}-2-(4-nitro-1H-pyrazol-1-yl)acetamide
N-{4-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]phenyl}-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | D041-0223 |
| Compound Name: | N-{4-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]phenyl}-2-(4-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 446.46 |
| Molecular Formula: | C23 H22 N6 O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc(c2ccc(cc2)NC(Cn2cc(cn2)[N+]([O-])=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.3585 |
| logD: | 5.3585 |
| logSw: | -5.1945 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.681 |
| InChI Key: | RDNSAVRRUOYYFP-UHFFFAOYSA-N |