1-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-2-methyl-4-nitro-1H-imidazole
Chemical Structure Depiction of
1-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-2-methyl-4-nitro-1H-imidazole
1-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-2-methyl-4-nitro-1H-imidazole
Compound characteristics
| Compound ID: | 1671-0001 |
| Compound Name: | 1-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-2-methyl-4-nitro-1H-imidazole |
| Molecular Weight: | 415.58 |
| Molecular Formula: | C24 H37 N3 O3 |
| Smiles: | CCC(C)(C)c1ccc(c(c1)C(C)(C)CC)OCCCCn1cc(nc1C)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0581 |
| logD: | 6.0581 |
| logSw: | -5.4019 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.314 |
| InChI Key: | LYSYQBVIUXIUPL-UHFFFAOYSA-N |