3-methyl-N-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}butanamide
Chemical Structure Depiction of
3-methyl-N-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}butanamide
3-methyl-N-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}butanamide
Compound characteristics
| Compound ID: | V029-2073 |
| Compound Name: | 3-methyl-N-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}butanamide |
| Molecular Weight: | 304.3 |
| Molecular Formula: | C14 H16 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CC(NCc1nc(c2ccc(cc2)[N+]([O-])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0566 |
| logD: | 3.0566 |
| logSw: | -3.4242 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.434 |
| InChI Key: | FRPKWMZKVPQKHR-UHFFFAOYSA-N |