About 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine
4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine (PubChem CID 130238337) has the molecular formula C28H19BrN2
and a molecular weight of 463.38 g/mol. Its IUPAC name is 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine.
Molecular Properties
| Compound Name | 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine |
| PubChem CID | 130238337 |
| Molecular Formula | C28H19BrN2 |
| Molecular Weight | 463.38 g/mol |
| Exact Mass | 462.07 |
| IUPAC Name | 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine |
| SMILES | Brc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccccn4)cc3)c2)cc1 |
| InChI | InChI=1S/C28H19BrN2/c29-25-15-13-20(14-16-25)24-18-27(21-6-2-1-3-7-21)31-28(19-24)23-11-9-22(10-12-23)26-8-4-5-17-30-26/h1-19H |
| InChIKey | XIVKNZMIQFHWPE-UHFFFAOYSA-N |
| XLogP | 7.91 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 31 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 463.38 |
| LogP ≤ 5 | 7.91 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine?
The IUPAC name of 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine (CID 130238337) is 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine.
What is the SMILES notation for 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine?
The canonical SMILES for 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine is Brc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccccn4)cc3)c2)cc1.
What is the InChIKey of 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine?
The InChIKey is XIVKNZMIQFHWPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H19BrN2/c29-25-15-13-20(14-16-25)24-18-27(21-6-2-1-3-7-21)31-28(19-24)23-11-9-22(10-12-23)26-8-4-5-17-30-26/h1-19H.
What are the key properties of 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine?
4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine has a molecular weight of 463.38 g/mol, XLogP of 7.91, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine is sourced from PubChem (CID 130238337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).