2-[3-acetyl-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-(prop-2-en-1-yl)phenyl acetate
Chemical Structure Depiction of
2-[3-acetyl-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-(prop-2-en-1-yl)phenyl acetate
2-[3-acetyl-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-(prop-2-en-1-yl)phenyl acetate
Compound characteristics
| Compound ID: | G642-1515 |
| Compound Name: | 2-[3-acetyl-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-(prop-2-en-1-yl)phenyl acetate |
| Molecular Weight: | 409.4 |
| Molecular Formula: | C21 H19 N3 O6 |
| Smiles: | CC(N1C(c2cccc(CC=C)c2OC(C)=O)OC(c2cccc(c2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8313 |
| logD: | 3.8313 |
| logSw: | -4.0415 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.557 |
| InChI Key: | HUWGRDUJVOVCOR-OAQYLSRUSA-N |