1-[2-(5-bromo-2,4-dimethoxyphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(5-bromo-2,4-dimethoxyphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[2-(5-bromo-2,4-dimethoxyphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-0147 |
| Compound Name: | 1-[2-(5-bromo-2,4-dimethoxyphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 450.24 |
| Molecular Formula: | C18 H16 Br N3 O6 |
| Smiles: | CC(N1C(c2cc(c(cc2OC)OC)[Br])OC(c2ccc(cc2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9195 |
| logD: | 3.9195 |
| logSw: | -4.1236 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.894 |
| InChI Key: | CTRYDGNVIIGDFO-SFHVURJKSA-N |