5-[3-acetyl-5-(4-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]benzene-1,2,3-triyl triacetate
Chemical Structure Depiction of
5-[3-acetyl-5-(4-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]benzene-1,2,3-triyl triacetate
5-[3-acetyl-5-(4-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]benzene-1,2,3-triyl triacetate
Compound characteristics
| Compound ID: | G642-6689 |
| Compound Name: | 5-[3-acetyl-5-(4-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]benzene-1,2,3-triyl triacetate |
| Molecular Weight: | 485.41 |
| Molecular Formula: | C22 H19 N3 O10 |
| Smiles: | CC(N1C(c2cc(c(c(c2)OC(C)=O)OC(C)=O)OC(C)=O)OC(c2ccc(cc2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.579 |
| logD: | 2.579 |
| logSw: | -3.1099 |
| Hydrogen bond acceptors count: | 17 |
| Polar surface area: | 131.232 |
| InChI Key: | FNAAGEGZTVPJPV-JOCHJYFZSA-N |