3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-ethylpiperazin-1-yl)propan-1-one
Chemical Structure Depiction of
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-ethylpiperazin-1-yl)propan-1-one
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-ethylpiperazin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | G729-0076 |
| Compound Name: | 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-ethylpiperazin-1-yl)propan-1-one |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C18 H24 N4 O4 S |
| Smiles: | CCN1CCN(CC1)C(CCc1nc(CS(c2ccccc2)(=O)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6545 |
| logD: | 0.334 |
| logSw: | -2.0337 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.266 |
| InChI Key: | NNBHWDXKXMDPMJ-UHFFFAOYSA-N |