3,3-dimethyl-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide
Chemical Structure Depiction of
3,3-dimethyl-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide
3,3-dimethyl-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide
Compound characteristics
| Compound ID: | V029-1610 |
| Compound Name: | 3,3-dimethyl-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide |
| Molecular Weight: | 374.44 |
| Molecular Formula: | C19 H26 N4 O4 |
| Smiles: | CCC(C)C(c1nc(c2cccc(c2)[N+]([O-])=O)no1)NC(CC(C)(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2047 |
| logD: | 5.2047 |
| logSw: | -5.0704 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.121 |
| InChI Key: | FVGBYVYHCYQNAM-UHFFFAOYSA-N |