N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-2059 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C21 H16 N4 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1nc(c2ccc(cc2)n2cccc2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9847 |
| logD: | 3.9847 |
| logSw: | -4.2631 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.43 |
| InChI Key: | IBBQTMVYFQGFIJ-UHFFFAOYSA-N |