2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(2,4-dimethoxyphenyl)acetamide
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | S333-0413 |
| Compound Name: | 2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 448.43 |
| Molecular Formula: | C23 H20 N4 O6 |
| Smiles: | COc1ccc(c(c1)OC)NC(Cn1cccc1c1nc(c2ccc3c(c2)OCO3)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3505 |
| logD: | 4.3503 |
| logSw: | -4.3849 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.975 |
| InChI Key: | CELXPCQODBGQAD-UHFFFAOYSA-N |