1-[2,5-bis(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[2,5-bis(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[2,5-bis(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8001-9126 |
| Compound Name: | 1-[2,5-bis(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 356.29 |
| Molecular Formula: | C16 H12 N4 O6 |
| Smiles: | CC(N1C(c2cccc(c2)[N+]([O-])=O)OC(c2cccc(c2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0569 |
| logD: | 3.0569 |
| logSw: | -3.2638 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 102.014 |
| InChI Key: | YMUNHWZQVPHLKF-INIZCTEOSA-N |