N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-2052 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 404.42 |
| Molecular Formula: | C22 H20 N4 O4 |
| Smiles: | COc1ccc(CNC(c2nc(c3ccc(cc3)n3cccc3)no2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6865 |
| logD: | 3.6865 |
| logSw: | -4.0217 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.576 |
| InChI Key: | OPTFPDLSPFMJOX-UHFFFAOYSA-N |