2-[4-acetyl-5-(4-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-5-hydroxyphenyl acetate
Chemical Structure Depiction of
2-[4-acetyl-5-(4-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-5-hydroxyphenyl acetate
2-[4-acetyl-5-(4-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-5-hydroxyphenyl acetate
Compound characteristics
| Compound ID: | G642-1998 |
| Compound Name: | 2-[4-acetyl-5-(4-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-5-hydroxyphenyl acetate |
| Molecular Weight: | 385.33 |
| Molecular Formula: | C18 H15 N3 O7 |
| Smiles: | CC(N1C(c2ccc(cc2)[N+]([O-])=O)OC(c2ccc(cc2OC(C)=O)O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2219 |
| logD: | 2.2203 |
| logSw: | -2.7762 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.088 |
| InChI Key: | GQYQDWDUAZIXPN-SFHVURJKSA-N |