4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine

C25H14BrF6N — CID 162353944

IUPAC4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2cc(-c3ccc(Br)cc3)cc(-c3ccc(C(F)(F)F)cc3)n2)cc1
InChIInChI=1S/C25H14BrF6N/c26-21-11-5-15(6-12-21)18-13-22(16-1-7-19(8-2-16)24(27,28)29)33-23(14-18)17-3-9-20(10-4-17)25(30,31)32/h1-14H
InChIKeyJPSLJAGOBVUJES-UHFFFAOYSA-N
MW522.29 g/mol
LogP8.88
Rot. Bonds3

About 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine

4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine (PubChem CID 162353944) has the molecular formula C25H14BrF6N and a molecular weight of 522.29 g/mol. Its IUPAC name is 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine
PubChem CID162353944
Molecular FormulaC25H14BrF6N
Molecular Weight522.29 g/mol
Exact Mass521.02
IUPAC Name4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2cc(-c3ccc(Br)cc3)cc(-c3ccc(C(F)(F)F)cc3)n2)cc1
InChIInChI=1S/C25H14BrF6N/c26-21-11-5-15(6-12-21)18-13-22(16-1-7-19(8-2-16)24(27,28)29)33-23(14-18)17-3-9-20(10-4-17)25(30,31)32/h1-14H
InChIKeyJPSLJAGOBVUJES-UHFFFAOYSA-N
XLogP8.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.29
LogP ≤ 58.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine 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

2,4,6-Triphenylpyridine
CID 136370
2-(4-Bromophenyl)quinoline
CID 1473444
2-Bromo-6-phenylpyridine
CID 568679
2-Bromo-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile
CID 1871785
1-(4-Bromophenyl)-2,4,6-triphenylpyridin-1-ium perchlorate
CID 12434472
2-Bromo-4,6-diphenylnicotinonitrile
CID 818430
2-[(E)-2-(4-bromophenyl)ethenyl]quinoline
CID 5463291
2-(4-Bromophenyl)-4,6-diphenylpyridine
CID 2801866
2-Bromo-4-(3-fluoro-phenyl)-6-phenyl-nicotinonitrile
CID 1105833
6-Bromo-2-(4-fluorophenyl)-4-phenylquinoline
CID 132547244
2-(3-Bromophenyl)-4-phenylquinoline
CID 30331091
4-(4-Fluorophenyl)-2,6-diphenylpyridine
CID 629756

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine (CID 162353944) is 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine is FC(F)(F)c1ccc(-c2cc(-c3ccc(Br)cc3)cc(-c3ccc(C(F)(F)F)cc3)n2)cc1.
What is the InChIKey of 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine?
The InChIKey is JPSLJAGOBVUJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H14BrF6N/c26-21-11-5-15(6-12-21)18-13-22(16-1-7-19(8-2-16)24(27,28)29)33-23(14-18)17-3-9-20(10-4-17)25(30,31)32/h1-14H.
What are the key properties of 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine?
4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine has a molecular weight of 522.29 g/mol, XLogP of 8.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-2,6-bis[4-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 162353944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).