1-[5-(3-nitrophenyl)-2-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(3-nitrophenyl)-2-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[5-(3-nitrophenyl)-2-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-0245 |
| Compound Name: | 1-[5-(3-nitrophenyl)-2-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 401.37 |
| Molecular Formula: | C19 H19 N3 O7 |
| Smiles: | CC(N1C(c2cc(c(c(c2)OC)OC)OC)OC(c2cccc(c2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9144 |
| logD: | 2.9144 |
| logSw: | -3.3126 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.611 |
| InChI Key: | QHIFXKZKYWBXRI-LJQANCHMSA-N |