1-(2-methylbenzene-1-sulfonyl)-3-(3-{2-[(oxan-4-yl)methoxy]ethyl}-1,2,4-oxadiazol-5-yl)piperidine
Chemical Structure Depiction of
1-(2-methylbenzene-1-sulfonyl)-3-(3-{2-[(oxan-4-yl)methoxy]ethyl}-1,2,4-oxadiazol-5-yl)piperidine
1-(2-methylbenzene-1-sulfonyl)-3-(3-{2-[(oxan-4-yl)methoxy]ethyl}-1,2,4-oxadiazol-5-yl)piperidine
Compound characteristics
Compound ID: | T955-1191 |
Compound Name: | 1-(2-methylbenzene-1-sulfonyl)-3-(3-{2-[(oxan-4-yl)methoxy]ethyl}-1,2,4-oxadiazol-5-yl)piperidine |
Molecular Weight: | 449.57 |
Molecular Formula: | C22 H31 N3 O5 S |
Smiles: | Cc1ccccc1S(N1CCCC(C1)c1nc(CCOCC2CCOCC2)no1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1231 |
logD: | 3.1231 |
logSw: | -3.2421 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 80.733 |
InChI Key: | GZRCOPKQWBWBET-IBGZPJMESA-N |