4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
Chemical Structure Depiction of
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
Compound characteristics
| Compound ID: | D349-2757 |
| Compound Name: | 4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline |
| Molecular Weight: | 422.4 |
| Molecular Formula: | C21 H18 N4 O6 |
| Smiles: | COc1ccc(cc1OC)c1nc(c2ccc(c(c2)[N+]([O-])=O)NCc2ccco2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.6998 |
| logD: | 4.6998 |
| logSw: | -4.5432 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.271 |
| InChI Key: | LHMQNIHJCXKGKA-UHFFFAOYSA-N |