4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(4-methylphenyl)methyl]-2-nitroaniline
Chemical Structure Depiction of
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(4-methylphenyl)methyl]-2-nitroaniline
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(4-methylphenyl)methyl]-2-nitroaniline
Compound characteristics
| Compound ID: | D349-2806 |
| Compound Name: | 4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(4-methylphenyl)methyl]-2-nitroaniline |
| Molecular Weight: | 446.46 |
| Molecular Formula: | C24 H22 N4 O5 |
| Smiles: | Cc1ccc(CNc2ccc(cc2[N+]([O-])=O)c2nc(c3ccc(c(c3)OC)OC)no2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3726 |
| logD: | 5.3726 |
| logSw: | -5.4641 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.522 |
| InChI Key: | SJSXODNODOAAMP-UHFFFAOYSA-N |