N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-3-nitrobenzamide
N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | V030-4234 |
| Compound Name: | N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-3-nitrobenzamide |
| Molecular Weight: | 474.47 |
| Molecular Formula: | C25 H22 N4 O6 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1OC)c1nc(C(Cc2ccccc2)NC(c2cccc(c2)[N+]([O-])=O)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7729 |
| logD: | 4.7715 |
| logSw: | -4.7441 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.33 |
| InChI Key: | UDDCIGOKJNIWSL-FQEVSTJZSA-N |