3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2,5-dimethoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2,5-dimethoxyphenyl)methyl]propanamide
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2,5-dimethoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | G729-0177 |
| Compound Name: | 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2,5-dimethoxyphenyl)methyl]propanamide |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | COc1ccc(c(CNC(CCc2nc(CS(c3ccccc3)(=O)=O)no2)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0989 |
| logD: | 2.0989 |
| logSw: | -2.8737 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.982 |
| InChI Key: | IZTNQPNNEAODMQ-UHFFFAOYSA-N |