N-benzyl-N-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-benzyl-N-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
N-benzyl-N-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | V030-5519 |
| Compound Name: | N-benzyl-N-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide |
| Molecular Weight: | 488.5 |
| Molecular Formula: | C26 H24 N4 O6 |
| Salt: | not_available |
| Smiles: | COc1cc(cc(c1)OC)c1nc(CCN(Cc2ccccc2)C(c2cccc(c2)[N+]([O-])=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.6512 |
| logD: | 4.6512 |
| logSw: | -4.547 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 95.968 |
| InChI Key: | KIXJHOPVUFEKSP-UHFFFAOYSA-N |