N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | V030-6605 |
| Compound Name: | N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide |
| Molecular Weight: | 398.37 |
| Molecular Formula: | C19 H18 N4 O6 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1OC)c1nc(CCNC(c2cccc(c2)[N+]([O-])=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.7997 |
| logD: | 2.7997 |
| logSw: | -3.4747 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.479 |
| InChI Key: | OHEXLYFHHARWSC-UHFFFAOYSA-N |