4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine

C28H19BrN2 — CID 130238337

IUPAC4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine
SMILESBrc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccccn4)cc3)c2)cc1
InChIInChI=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
InChIKeyXIVKNZMIQFHWPE-UHFFFAOYSA-N
MW463.38 g/mol
LogP7.91
Rot. Bonds4

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 Name4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine
PubChem CID130238337
Molecular FormulaC28H19BrN2
Molecular Weight463.38 g/mol
Exact Mass462.07
IUPAC Name4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine
SMILESBrc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccccn4)cc3)c2)cc1
InChIInChI=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
InChIKeyXIVKNZMIQFHWPE-UHFFFAOYSA-N
XLogP7.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.38
LogP ≤ 57.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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).