6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine

C21H13BrF4N2 — CID 51360603

IUPAC6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2nc3ccc(Br)cn3c2Cc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C21H13BrF4N2/c22-15-7-10-19-27-20(13-5-8-16(23)9-6-13)18(28(19)12-15)11-14-3-1-2-4-17(14)21(24,25)26/h1-10,12H,11H2
InChIKeySLOJKZJGLZOGEC-UHFFFAOYSA-N
MW449.25 g/mol
LogP6.51
Rot. Bonds3

About 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine

6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine (PubChem CID 51360603) has the molecular formula C21H13BrF4N2 and a molecular weight of 449.25 g/mol. Its IUPAC name is 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
PubChem CID51360603
Molecular FormulaC21H13BrF4N2
Molecular Weight449.25 g/mol
Exact Mass448.02
IUPAC Name6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2nc3ccc(Br)cn3c2Cc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C21H13BrF4N2/c22-15-7-10-19-27-20(13-5-8-16(23)9-6-13)18(28(19)12-15)11-14-3-1-2-4-17(14)21(24,25)26/h1-10,12H,11H2
InChIKeySLOJKZJGLZOGEC-UHFFFAOYSA-N
XLogP6.51
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.25
LogP ≤ 56.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine (CID 51360603) is 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine is Fc1ccc(-c2nc3ccc(Br)cn3c2Cc2ccccc2C(F)(F)F)cc1.
What is the InChIKey of 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is SLOJKZJGLZOGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13BrF4N2/c22-15-7-10-19-27-20(13-5-8-16(23)9-6-13)18(28(19)12-15)11-14-3-1-2-4-17(14)21(24,25)26/h1-10,12H,11H2.
What are the key properties of 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 449.25 g/mol, XLogP of 6.51, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-fluorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 51360603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).