3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | G729-1066 |
| Compound Name: | 3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(4-sulfamoylphenyl)ethyl]propanamide |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C21 H24 N4 O6 S2 |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(CCC(NCCc2ccc(cc2)S(N)(=O)=O)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6426 |
| logD: | 0.6419 |
| logSw: | -2.1523 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 136.253 |
| InChI Key: | WXDIRQRHPOFHRC-UHFFFAOYSA-N |