1-[2-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[2-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-0019 |
| Compound Name: | 1-[2-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 425.83 |
| Molecular Formula: | C20 H16 Cl N5 O4 |
| Smiles: | CC(N1C(c2c(C)nn(c3ccccc3)c2[Cl])OC(c2cccc(c2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5929 |
| logD: | 3.5929 |
| logSw: | -3.952 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.432 |
| InChI Key: | FSKVDRAKZWKHOZ-FQEVSTJZSA-N |