3-{4-[(4-nitrophenyl)methoxy]phenyl}-5-(propan-2-yl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-{4-[(4-nitrophenyl)methoxy]phenyl}-5-(propan-2-yl)-1,2,4-oxadiazole
3-{4-[(4-nitrophenyl)methoxy]phenyl}-5-(propan-2-yl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | V022-0739 |
| Compound Name: | 3-{4-[(4-nitrophenyl)methoxy]phenyl}-5-(propan-2-yl)-1,2,4-oxadiazole |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C18 H17 N3 O4 |
| Smiles: | CC(C)c1nc(c2ccc(cc2)OCc2ccc(cc2)[N+]([O-])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.1656 |
| logD: | 5.1656 |
| logSw: | -5.1901 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.525 |
| InChI Key: | QSDCWUIMLFULNF-UHFFFAOYSA-N |