1-[5-(4-nitrophenyl)-2-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(4-nitrophenyl)-2-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[5-(4-nitrophenyl)-2-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | F076-0600 |
| Compound Name: | 1-[5-(4-nitrophenyl)-2-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 449.38 |
| Molecular Formula: | C21 H15 N5 O7 |
| Smiles: | CC(N1C(c2ccc(cc2)Oc2ccc(cn2)[N+]([O-])=O)OC(c2ccc(cc2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5866 |
| logD: | 3.5866 |
| logSw: | -3.5405 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 117.8 |
| InChI Key: | HYKJVQFLSXKINO-NRFANRHFSA-N |