3-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-chloro-2-methylphenyl)-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-(3-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | G026-0300 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole |
| Molecular Weight: | 395.8 |
| Molecular Formula: | C19 H14 Cl N5 O3 |
| Smiles: | Cc1c(cccc1[Cl])n1c(C)c(c2nc(c3ccc4c(c3)OCO4)no2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.7099 |
| logD: | 4.7099 |
| logSw: | -4.9935 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.302 |
| InChI Key: | WGRRKBUYVSSRBO-UHFFFAOYSA-N |