2-[4-acetyl-5-(2-chloro-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl acetate
Chemical Structure Depiction of
2-[4-acetyl-5-(2-chloro-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl acetate
2-[4-acetyl-5-(2-chloro-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl acetate
Compound characteristics
| Compound ID: | G642-1648 |
| Compound Name: | 2-[4-acetyl-5-(2-chloro-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl acetate |
| Molecular Weight: | 403.78 |
| Molecular Formula: | C18 H14 Cl N3 O6 |
| Smiles: | CC(N1C(c2cc(ccc2[Cl])[N+]([O-])=O)OC(c2ccccc2OC(C)=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3533 |
| logD: | 3.3533 |
| logSw: | -3.8813 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.47 |
| InChI Key: | SXUPICKBDFMOGB-SFHVURJKSA-N |