2-(4-bromophenyl)-4,6-diphenylpyridine

C23H16BrN — CID 2801866

IUPAC2-(4-bromophenyl)-4,6-diphenylpyridine
SMILESBrc1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H16BrN/c24-21-13-11-19(12-14-21)23-16-20(17-7-3-1-4-8-17)15-22(25-23)18-9-5-2-6-10-18/h1-16H
InChIKeyDFXSMHFTDYOITI-UHFFFAOYSA-N
MW386.29 g/mol
LogP6.85
Rot. Bonds3

About 2-(4-bromophenyl)-4,6-diphenylpyridine

2-(4-bromophenyl)-4,6-diphenylpyridine (PubChem CID 2801866) has the molecular formula C23H16BrN and a molecular weight of 386.29 g/mol. Its IUPAC name is 2-(4-bromophenyl)-4,6-diphenylpyridine.

Molecular Properties

Compound Name2-(4-bromophenyl)-4,6-diphenylpyridine
PubChem CID2801866
Molecular FormulaC23H16BrN
Molecular Weight386.29 g/mol
Exact Mass385.05
IUPAC Name2-(4-bromophenyl)-4,6-diphenylpyridine
SMILESBrc1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H16BrN/c24-21-13-11-19(12-14-21)23-16-20(17-7-3-1-4-8-17)15-22(25-23)18-9-5-2-6-10-18/h1-16H
InChIKeyDFXSMHFTDYOITI-UHFFFAOYSA-N
XLogP6.85
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.29
LogP ≤ 56.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-4,6-diphenylpyridine?
The IUPAC name of 2-(4-bromophenyl)-4,6-diphenylpyridine (CID 2801866) is 2-(4-bromophenyl)-4,6-diphenylpyridine.
What is the SMILES notation for 2-(4-bromophenyl)-4,6-diphenylpyridine?
The canonical SMILES for 2-(4-bromophenyl)-4,6-diphenylpyridine is Brc1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-4,6-diphenylpyridine?
The InChIKey is DFXSMHFTDYOITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16BrN/c24-21-13-11-19(12-14-21)23-16-20(17-7-3-1-4-8-17)15-22(25-23)18-9-5-2-6-10-18/h1-16H.
What are the key properties of 2-(4-bromophenyl)-4,6-diphenylpyridine?
2-(4-bromophenyl)-4,6-diphenylpyridine has a molecular weight of 386.29 g/mol, XLogP of 6.85, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-4,6-diphenylpyridine is sourced from PubChem (CID 2801866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).