3-(2H-1,3-benzodioxol-5-yl)-5-[1-(5-chloro-2,4-dimethoxyphenyl)-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-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-[1-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | G026-0307 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-[1-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole |
| Molecular Weight: | 441.83 |
| Molecular Formula: | C20 H16 Cl N5 O5 |
| Smiles: | Cc1c(c2nc(c3ccc4c(c3)OCO4)no2)nnn1c1cc(c(cc1OC)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3539 |
| logD: | 4.3539 |
| logSw: | -4.6146 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 90.563 |
| InChI Key: | ZJTPBKDOZRFOPI-UHFFFAOYSA-N |