2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(4-methylphenyl)methyl]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-[(4-methylphenyl)methyl]acetamide
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | S333-0441 |
| Compound Name: | 2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 416.44 |
| Molecular Formula: | C23 H20 N4 O4 |
| Smiles: | Cc1ccc(CNC(Cn2cccc2c2nc(c3ccc4c(c3)OCO4)no2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6064 |
| logD: | 4.6064 |
| logSw: | -4.3513 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.821 |
| InChI Key: | NHPQFLNJSRSUGP-UHFFFAOYSA-N |