2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine

C24H18BrNO — CID 2801861

IUPAC2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine
SMILESCOc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(Br)cc3)n2)cc1
InChIInChI=1S/C24H18BrNO/c1-27-22-13-9-19(10-14-22)24-16-20(17-5-3-2-4-6-17)15-23(26-24)18-7-11-21(25)12-8-18/h2-16H,1H3
InChIKeyXRYXKOGBZQGAJU-UHFFFAOYSA-N
MW416.32 g/mol
LogP6.85
Rot. Bonds4

About 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine

2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine (PubChem CID 2801861) has the molecular formula C24H18BrNO and a molecular weight of 416.32 g/mol. Its IUPAC name is 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine.

Molecular Properties

Compound Name2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine
PubChem CID2801861
Molecular FormulaC24H18BrNO
Molecular Weight416.32 g/mol
Exact Mass415.06
IUPAC Name2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine
SMILESCOc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(Br)cc3)n2)cc1
InChIInChI=1S/C24H18BrNO/c1-27-22-13-9-19(10-14-22)24-16-20(17-5-3-2-4-6-17)15-23(26-24)18-7-11-21(25)12-8-18/h2-16H,1H3
InChIKeyXRYXKOGBZQGAJU-UHFFFAOYSA-N
XLogP6.85
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.32
LogP ≤ 56.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 1481967
CID 1481967
CID 91971313
CID 91971313
CID 11065299
CID 11065299
CID 1719430
CID 1719430
CID 52950002
CID 52950002
CID 118444192
CID 118444192
CID 141482524
CID 141482524
CID 740843
CID 740843
CID 1350383
CID 1350383
CID 16196195
CID 16196195
CID 44313413
CID 44313413
CID 145981128
CID 145981128

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine?
The IUPAC name of 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine (CID 2801861) is 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine.
What is the SMILES notation for 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine?
The canonical SMILES for 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine is COc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(Br)cc3)n2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine?
The InChIKey is XRYXKOGBZQGAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18BrNO/c1-27-22-13-9-19(10-14-22)24-16-20(17-5-3-2-4-6-17)15-23(26-24)18-7-11-21(25)12-8-18/h2-16H,1H3.
What are the key properties of 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine?
2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine has a molecular weight of 416.32 g/mol, XLogP of 6.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine is sourced from PubChem (CID 2801861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).