1-[2-(2-chloro-7-methylquinolin-3-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(2-chloro-7-methylquinolin-3-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[2-(2-chloro-7-methylquinolin-3-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-1533 |
| Compound Name: | 1-[2-(2-chloro-7-methylquinolin-3-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 410.81 |
| Molecular Formula: | C20 H15 Cl N4 O4 |
| Smiles: | CC(N1C(c2cc3ccc(C)cc3nc2[Cl])OC(c2cccc(c2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5949 |
| logD: | 4.5949 |
| logSw: | -4.8447 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.601 |
| InChI Key: | KBTXOYVSRXNQGO-FQEVSTJZSA-N |