4-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}morpholine
Chemical Structure Depiction of
4-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}morpholine
4-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}morpholine
Compound characteristics
Compound ID: | D349-2749 |
Compound Name: | 4-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}morpholine |
Molecular Weight: | 412.4 |
Molecular Formula: | C20 H20 N4 O6 |
Smiles: | COc1ccc(cc1OC)c1nc(c2ccc(c(c2)[N+]([O-])=O)N2CCOCC2)on1 |
Stereo: | ACHIRAL |
logP: | 3.3768 |
logD: | 3.3768 |
logSw: | -3.7393 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 91.046 |
InChI Key: | STAKTIXHRCVLET-UHFFFAOYSA-N |