3-(2H-1,3-benzodioxol-5-yl)-5-(1-benzyl-3-nitro-1H-pyrazol-5-yl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-(1-benzyl-3-nitro-1H-pyrazol-5-yl)-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-(1-benzyl-3-nitro-1H-pyrazol-5-yl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | 8018-1976 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-(1-benzyl-3-nitro-1H-pyrazol-5-yl)-1,2,4-oxadiazole |
| Molecular Weight: | 391.34 |
| Molecular Formula: | C19 H13 N5 O5 |
| Smiles: | C(c1ccccc1)n1c(cc(n1)[N+]([O-])=O)c1nc(c2ccc3c(c2)OCO3)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.8352 |
| logD: | 3.8352 |
| logSw: | -4.2389 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 94.563 |
| InChI Key: | OYIAITLQBGQPSG-UHFFFAOYSA-N |