5-[3-(4-nitro-1H-pyrazol-1-yl)propyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[3-(4-nitro-1H-pyrazol-1-yl)propyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
5-[3-(4-nitro-1H-pyrazol-1-yl)propyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | 8016-0005 |
| Compound Name: | 5-[3-(4-nitro-1H-pyrazol-1-yl)propyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 364.36 |
| Molecular Formula: | C18 H16 N6 O3 |
| Smiles: | C(Cc1nc(c2ccc(cc2)n2cccc2)no1)Cn1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3076 |
| logD: | 3.3076 |
| logSw: | -3.3867 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 83.433 |
| InChI Key: | RDGMOZVHQZIRFE-UHFFFAOYSA-N |