3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-{[4-(dimethylamino)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-{[4-(dimethylamino)phenyl]methyl}propanamide
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-{[4-(dimethylamino)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | G729-0294 |
| Compound Name: | 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-{[4-(dimethylamino)phenyl]methyl}propanamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | CN(C)c1ccc(CNC(CCc2nc(CS(c3ccccc3)(=O)=O)no2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9889 |
| logD: | 1.9735 |
| logSw: | -2.5175 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.613 |
| InChI Key: | ICTRQZJDLLTFHG-UHFFFAOYSA-N |