N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-phenyl-N-(propan-2-yl)prop-2-enamide
Chemical Structure Depiction of
N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-phenyl-N-(propan-2-yl)prop-2-enamide
N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-phenyl-N-(propan-2-yl)prop-2-enamide
Compound characteristics
| Compound ID: | V029-1407 |
| Compound Name: | N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-phenyl-N-(propan-2-yl)prop-2-enamide |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)N(CCc1nc(c2cccc(c2)[N+]([O-])=O)no1)C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0877 |
| logD: | 5.0874 |
| logSw: | -4.9857 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.369 |
| InChI Key: | DLERXBUTJKBMGY-UHFFFAOYSA-N |