N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
Compound characteristics
| Compound ID: | V012-6276 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide |
| Molecular Weight: | 496.56 |
| Molecular Formula: | C26 H32 N4 O6 |
| Smiles: | CC(C)(C)CC(N(CCc1ccc(c(c1)OC)OC)CCc1nc(c2cccc(c2)[N+]([O-])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9769 |
| logD: | 4.9769 |
| logSw: | -4.8429 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 95.864 |
| InChI Key: | LAWAZTRBPSVKAG-UHFFFAOYSA-N |