3-(2H-1,3-benzodioxol-5-yl)-5-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole
Compound characteristics
Compound ID: | G026-0277 |
Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole |
Molecular Weight: | 347.33 |
Molecular Formula: | C18 H13 N5 O3 |
Smiles: | Cc1c(c2nc(c3ccc4c(c3)OCO4)no2)nnn1c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.5561 |
logD: | 3.5561 |
logSw: | -3.6744 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 75.603 |
InChI Key: | BRVLTFUTXJGZSG-UHFFFAOYSA-N |