3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | G603-0044 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C21 H21 N3 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CCCC(C1)c1nc(c2ccc3c(c2)OCO3)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6578 |
| logD: | 4.6578 |
| logSw: | -4.4586 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.404 |
| InChI Key: | UKPMRXBBZZFPJS-INIZCTEOSA-N |