5-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]-1-propyl-1H-benzotriazole
Chemical Structure Depiction of
5-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]-1-propyl-1H-benzotriazole
5-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]-1-propyl-1H-benzotriazole
Compound characteristics
| Compound ID: | G944-0366 |
| Compound Name: | 5-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]-1-propyl-1H-benzotriazole |
| Molecular Weight: | 349.35 |
| Molecular Formula: | C18 H15 N5 O3 |
| Smiles: | CCCn1c2ccc(cc2nn1)c1nc(c2ccc3c(c2)OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.948 |
| logD: | 3.948 |
| logSw: | -3.9906 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.436 |
| InChI Key: | BJVUSFYSZZGTPO-UHFFFAOYSA-N |