3-(2H-1,3-benzodioxol-5-yl)-5-[3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-[3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-[3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | 8017-8819 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-[3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-1,2,4-oxadiazole |
| Molecular Weight: | 357.32 |
| Molecular Formula: | C16 H15 N5 O5 |
| Smiles: | Cc1cc(nn1CCCc1nc(c2ccc3c(c2)OCO3)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.497 |
| logD: | 2.497 |
| logSw: | -2.6112 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 95.449 |
| InChI Key: | USTVDOVRTKBVQQ-UHFFFAOYSA-N |