1-[5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-2-(2,5-dimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-2-(2,5-dimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-2-(2,5-dimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-0534 |
| Compound Name: | 1-[5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-2-(2,5-dimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 400.39 |
| Molecular Formula: | C20 H20 N2 O7 |
| Smiles: | CC(N1C(c2cc(ccc2OC)OC)OC(COc2ccc3c(c2)OCO3)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1504 |
| logD: | 3.1504 |
| logSw: | -3.1883 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.186 |
| InChI Key: | YOJYOMLNYROZDZ-FQEVSTJZSA-N |