3-{4-[(2-methylphenyl)methoxy]phenyl}-5-(3-nitrophenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-{4-[(2-methylphenyl)methoxy]phenyl}-5-(3-nitrophenyl)-1,2,4-oxadiazole
3-{4-[(2-methylphenyl)methoxy]phenyl}-5-(3-nitrophenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | V014-3551 |
| Compound Name: | 3-{4-[(2-methylphenyl)methoxy]phenyl}-5-(3-nitrophenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 387.39 |
| Molecular Formula: | C22 H17 N3 O4 |
| Smiles: | Cc1ccccc1COc1ccc(cc1)c1nc(c2cccc(c2)[N+]([O-])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 6.0722 |
| logD: | 6.0722 |
| logSw: | -5.7382 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.253 |
| InChI Key: | IHLVOWUZWYKOHG-UHFFFAOYSA-N |