About 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole
1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole (PubChem CID 144582835) has the molecular formula C30H23FN2O
and a molecular weight of 446.53 g/mol. Its IUPAC name is 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole.
Molecular Properties
| Compound Name | 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole |
| PubChem CID | 144582835 |
| Molecular Formula | C30H23FN2O |
| Molecular Weight | 446.53 g/mol |
| Exact Mass | 446.18 |
| IUPAC Name | 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole |
| SMILES | CC(C)c1cccc(-c2cccc3c2oc2ccccc23)c1-n1ccnc1-c1ccc(F)cc1 |
| InChI | InChI=1S/C30H23FN2O/c1-19(2)22-8-5-9-24(26-11-6-10-25-23-7-3-4-12-27(23)34-29(25)26)28(22)33-18-17-32-30(33)20-13-15-21(31)16-14-20/h3-19H,1-2H3 |
| InChIKey | SOORXRJTSRSUDO-UHFFFAOYSA-N |
| XLogP | 8.37 |
| TPSA | 30.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 34 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 446.53 |
| LogP ≤ 5 | 8.37 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
The IUPAC name of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole (CID 144582835) is 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole.
What is the SMILES notation for 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
The canonical SMILES for 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole is CC(C)c1cccc(-c2cccc3c2oc2ccccc23)c1-n1ccnc1-c1ccc(F)cc1.
What is the InChIKey of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
The InChIKey is SOORXRJTSRSUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23FN2O/c1-19(2)22-8-5-9-24(26-11-6-10-25-23-7-3-4-12-27(23)34-29(25)26)28(22)33-18-17-32-30(33)20-13-15-21(31)16-14-20/h3-19H,1-2H3.
What are the key properties of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole has a molecular weight of 446.53 g/mol, XLogP of 8.37, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole is sourced from PubChem (CID 144582835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).