3-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | G026-0287 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole |
| Molecular Weight: | 375.39 |
| Molecular Formula: | C20 H17 N5 O3 |
| Smiles: | CCc1ccccc1n1c(C)c(c2nc(c3ccc4c(c3)OCO4)no2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.4334 |
| logD: | 4.4334 |
| logSw: | -4.3491 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.302 |
| InChI Key: | KWTZRDRSFNWPDZ-UHFFFAOYSA-N |