3,3-dimethyl-N-(2-methylpropyl)-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
Chemical Structure Depiction of
3,3-dimethyl-N-(2-methylpropyl)-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
3,3-dimethyl-N-(2-methylpropyl)-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
Compound characteristics
| Compound ID: | V029-5517 |
| Compound Name: | 3,3-dimethyl-N-(2-methylpropyl)-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C20 H28 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CN(CCc1nc(c2ccc(cc2)[N+]([O-])=O)no1)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.149 |
| logD: | 5.149 |
| logSw: | -5.0092 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.896 |
| InChI Key: | NVDFAURDVZBIDM-UHFFFAOYSA-N |