3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]propanamide
Chemical Structure Depiction of
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]propanamide
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]propanamide
Compound characteristics
| Compound ID: | G729-0136 |
| Compound Name: | 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]propanamide |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C20 H19 N3 O6 S |
| Smiles: | C(Cc1nc(CS(c2ccccc2)(=O)=O)no1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.812 |
| logD: | 1.812 |
| logSw: | -2.5843 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.924 |
| InChI Key: | BRSRAUVQXHEBQW-UHFFFAOYSA-N |