4-(3-bromophenyl)-2,6-diphenylpyridine

C23H16BrN — CID 3730816

IUPAC4-(3-bromophenyl)-2,6-diphenylpyridine
SMILESBrc1cccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)c1
InChIInChI=1S/C23H16BrN/c24-21-13-7-12-19(14-21)20-15-22(17-8-3-1-4-9-17)25-23(16-20)18-10-5-2-6-11-18/h1-16H
InChIKeyDANHLDSMEAQMAU-UHFFFAOYSA-N
MW386.29 g/mol
LogP6.85
Rot. Bonds3

About 4-(3-bromophenyl)-2,6-diphenylpyridine

4-(3-bromophenyl)-2,6-diphenylpyridine (PubChem CID 3730816) has the molecular formula C23H16BrN and a molecular weight of 386.29 g/mol. Its IUPAC name is 4-(3-bromophenyl)-2,6-diphenylpyridine.

Molecular Properties

Compound Name4-(3-bromophenyl)-2,6-diphenylpyridine
PubChem CID3730816
Molecular FormulaC23H16BrN
Molecular Weight386.29 g/mol
Exact Mass385.05
IUPAC Name4-(3-bromophenyl)-2,6-diphenylpyridine
SMILESBrc1cccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)c1
InChIInChI=1S/C23H16BrN/c24-21-13-7-12-19(14-21)20-15-22(17-8-3-1-4-9-17)25-23(16-20)18-10-5-2-6-11-18/h1-16H
InChIKeyDANHLDSMEAQMAU-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 4-(3-bromophenyl)-2,6-diphenylpyridine?
The IUPAC name of 4-(3-bromophenyl)-2,6-diphenylpyridine (CID 3730816) is 4-(3-bromophenyl)-2,6-diphenylpyridine.
What is the SMILES notation for 4-(3-bromophenyl)-2,6-diphenylpyridine?
The canonical SMILES for 4-(3-bromophenyl)-2,6-diphenylpyridine is Brc1cccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)c1.
What is the InChIKey of 4-(3-bromophenyl)-2,6-diphenylpyridine?
The InChIKey is DANHLDSMEAQMAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16BrN/c24-21-13-7-12-19(14-21)20-15-22(17-8-3-1-4-9-17)25-23(16-20)18-10-5-2-6-11-18/h1-16H.
What are the key properties of 4-(3-bromophenyl)-2,6-diphenylpyridine?
4-(3-bromophenyl)-2,6-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 4-(3-bromophenyl)-2,6-diphenylpyridine is sourced from PubChem (CID 3730816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).