6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine

C15H13BrN2S — CID 115404929

IUPAC6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine
SMILESCSc1ccc(-c2cn3cc(Br)c(C)cc3n2)cc1
InChIInChI=1S/C15H13BrN2S/c1-10-7-15-17-14(9-18(15)8-13(10)16)11-3-5-12(19-2)6-4-11/h3-9H,1-2H3
InChIKeyZDVOTBGNFOWGKF-UHFFFAOYSA-N
MW333.25 g/mol
LogP4.79
Rot. Bonds2

About 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine

6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine (PubChem CID 115404929) has the molecular formula C15H13BrN2S and a molecular weight of 333.25 g/mol. Its IUPAC name is 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine
PubChem CID115404929
Molecular FormulaC15H13BrN2S
Molecular Weight333.25 g/mol
Exact Mass332.00
IUPAC Name6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine
SMILESCSc1ccc(-c2cn3cc(Br)c(C)cc3n2)cc1
InChIInChI=1S/C15H13BrN2S/c1-10-7-15-17-14(9-18(15)8-13(10)16)11-3-5-12(19-2)6-4-11/h3-9H,1-2H3
InChIKeyZDVOTBGNFOWGKF-UHFFFAOYSA-N
XLogP4.79
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.25
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
CID 46307196
6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 115404928
2-(4-methylphenyl)-6-methylsulfanylimidazo[1,2-a]pyridine
CID 15179822
6-bromo-7-methyl-2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 115404807
6-chloro-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine
CID 78910138
6-bromo-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyrimidine
CID 115404681
2-(1-benzothiophen-2-yl)-6-bromo-7-methylimidazo[1,2-a]pyridine
CID 114911433
2-(3-bromo-4-fluorophenyl)-6-methylimidazo[1,2-a]pyridine
CID 113303187
2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-6-amine
CID 82060154
2-(4-tert-butylphenyl)-7-methylimidazo[1,2-a]pyridine
CID 4837144
2-(4-methylsulfanylphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 54458815
1-methyl-4-[4-(4-methylsulfanylphenyl)phenyl]benzene
CID 130214671

Frequently Asked Questions

What is the IUPAC name of 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine (CID 115404929) is 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine is CSc1ccc(-c2cn3cc(Br)c(C)cc3n2)cc1.
What is the InChIKey of 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine?
The InChIKey is ZDVOTBGNFOWGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2S/c1-10-7-15-17-14(9-18(15)8-13(10)16)11-3-5-12(19-2)6-4-11/h3-9H,1-2H3.
What are the key properties of 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine?
6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine has a molecular weight of 333.25 g/mol, XLogP of 4.79, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 115404929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).