N-[2-(3,4-dimethoxyphenyl)ethyl]-3-fluoro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-fluoro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-fluoro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | V029-5386 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-fluoro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide |
| Molecular Weight: | 520.52 |
| Molecular Formula: | C27 H25 F N4 O6 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCN(CCc2nc(c3ccc(cc3)[N+]([O-])=O)no2)C(c2cccc(c2)F)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.5204 |
| logD: | 4.5204 |
| logSw: | -4.4968 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 96.12 |
| InChI Key: | OQMZLUIQVPYIFU-UHFFFAOYSA-N |