4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-nitrobenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-nitrobenzene-1-sulfonyl)piperidine
4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-nitrobenzene-1-sulfonyl)piperidine
Compound characteristics
Compound ID: | V014-1036 |
Compound Name: | 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-nitrobenzene-1-sulfonyl)piperidine |
Molecular Weight: | 444.46 |
Molecular Formula: | C20 H20 N4 O6 S |
Smiles: | COc1ccc(cc1)c1nc(C2CCN(CC2)S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)on1 |
Stereo: | ACHIRAL |
logP: | 4.3595 |
logD: | 4.3595 |
logSw: | -4.2244 |
Hydrogen bond acceptors count: | 13 |
Polar surface area: | 104.281 |
InChI Key: | ZLCLFAFHSWJJCW-UHFFFAOYSA-N |