5-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-1,3-phenylene diacetate
Chemical Structure Depiction of
5-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-1,3-phenylene diacetate
5-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-1,3-phenylene diacetate
Compound characteristics
| Compound ID: | G642-1641 |
| Compound Name: | 5-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-1,3-phenylene diacetate |
| Molecular Weight: | 427.37 |
| Molecular Formula: | C20 H17 N3 O8 |
| Smiles: | CC(N1C(c2ccccc2[N+]([O-])=O)OC(c2cc(cc(c2)OC(C)=O)OC(C)=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9828 |
| logD: | 1.9828 |
| logSw: | -2.5573 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 109.834 |
| InChI Key: | KJFSRNBOZKEDJN-FQEVSTJZSA-N |