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

C21H13BrClF3N2 — CID 51360604

IUPAC6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
SMILESFC(F)(F)c1ccccc1Cc1c(-c2ccc(Cl)cc2)nc2ccc(Br)cn12
InChIInChI=1S/C21H13BrClF3N2/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
InChIKeyGOWDUZLBLDGDRC-UHFFFAOYSA-N
MW465.70 g/mol
LogP7.03
Rot. Bonds3

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

6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine (PubChem CID 51360604) has the molecular formula C21H13BrClF3N2 and a molecular weight of 465.70 g/mol. Its IUPAC name is 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
PubChem CID51360604
Molecular FormulaC21H13BrClF3N2
Molecular Weight465.70 g/mol
Exact Mass463.99
IUPAC Name6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
SMILESFC(F)(F)c1ccccc1Cc1c(-c2ccc(Cl)cc2)nc2ccc(Br)cn12
InChIInChI=1S/C21H13BrClF3N2/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
InChIKeyGOWDUZLBLDGDRC-UHFFFAOYSA-N
XLogP7.03
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.70
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[6-bromo-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 170878846
6-bromo-2-(3-chlorophenyl)-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 51360616
4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
CID 121309666
6-chloro-3-(chloromethyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridine;hydrochloride
CID 67028658
6-bromo-2-(3-chlorophenyl)-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine
CID 51361246
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 53036596
2-(3-bromophenyl)-6-chloro-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 51360607
6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine
CID 1154272
6-chloro-3-[(4-methylphenyl)methyl]-2-phenylimidazo[1,2-a]pyridine
CID 46904877
2-[4-(trifluoromethyl)phenyl]-3-[[2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]imidazo[1,2-a]pyridine
CID 132518642
2-(4-bromophenyl)-6-chloro-3-methylimidazo[1,2-a]pyridine
CID 78910128
[6-chloro-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 39132848

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine (CID 51360604) is 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine is FC(F)(F)c1ccccc1Cc1c(-c2ccc(Cl)cc2)nc2ccc(Br)cn12.
What is the InChIKey of 6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is GOWDUZLBLDGDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13BrClF3N2/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-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 465.70 g/mol, XLogP of 7.03, 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-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 51360604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).