1-[5-(4-chlorophenyl)-2-[4-(2,4-dinitrophenoxy)phenyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(4-chlorophenyl)-2-[4-(2,4-dinitrophenoxy)phenyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[5-(4-chlorophenyl)-2-[4-(2,4-dinitrophenoxy)phenyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | F076-0582 |
| Compound Name: | 1-[5-(4-chlorophenyl)-2-[4-(2,4-dinitrophenoxy)phenyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 482.84 |
| Molecular Formula: | C22 H15 Cl N4 O7 |
| Smiles: | CC(N1C(c2ccc(cc2)Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)OC(c2ccc(cc2)[Cl])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9468 |
| logD: | 4.9468 |
| logSw: | -5.4626 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 108.548 |
| InChI Key: | MZYWVGYWDIJLJJ-JOCHJYFZSA-N |