N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)butyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)butyl]-3-nitrobenzamide
N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)butyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | V029-2065 |
| Compound Name: | N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)butyl]-3-nitrobenzamide |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C20 H20 N4 O4 |
| Salt: | not_available |
| Smiles: | CCC(C)C(c1nc(c2ccccc2)no1)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0069 |
| logD: | 5.0067 |
| logSw: | -4.6312 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.063 |
| InChI Key: | GWCLVCWTAXGMBV-UHFFFAOYSA-N |