5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine

C17H12BrN3S — CID 10361780

IUPAC5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine
SMILESBrc1ccc(Cn2ccc3nc(-c4cccs4)nc-3c2)cc1
InChIInChI=1S/C17H12BrN3S/c18-13-5-3-12(4-6-13)10-21-8-7-14-15(11-21)20-17(19-14)16-2-1-9-22-16/h1-9,11H,10H2
InChIKeyMJZIGSVUFVWPSA-UHFFFAOYSA-N
MW370.28 g/mol
LogP4.92
Rot. Bonds3

About 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine

5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine (PubChem CID 10361780) has the molecular formula C17H12BrN3S and a molecular weight of 370.28 g/mol. Its IUPAC name is 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine
PubChem CID10361780
Molecular FormulaC17H12BrN3S
Molecular Weight370.28 g/mol
Exact Mass368.99
IUPAC Name5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine
SMILESBrc1ccc(Cn2ccc3nc(-c4cccs4)nc-3c2)cc1
InChIInChI=1S/C17H12BrN3S/c18-13-5-3-12(4-6-13)10-21-8-7-14-15(11-21)20-17(19-14)16-2-1-9-22-16/h1-9,11H,10H2
InChIKeyMJZIGSVUFVWPSA-UHFFFAOYSA-N
XLogP4.92
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.28
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-Bromo-2-thienyl)imidazo[1,2-a]pyridine
CID 711734
2-(4-Bromophenyl)benzo[d]imidazo[2,1-b]thiazole
CID 667715
N-benzyl-6-methyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
CID 808829
2-(4-Bromophenyl)imidazo[1,2-a]pyrimidine
CID 3236423
2-(3-Bromophenyl)-5-[(4-bromophenyl)methyl]imidazo[4,5-c]pyridine
CID 9980830
5-[(4-Bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine
CID 10045421
5-[(5-Chloro-2-thienyl)methyl]-2-phenyl-5h-imidazo[4,5-c]pyridine
CID 10064916
5-[(4-Bromophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
CID 10362465
5-((4-bromophenyl)methyl)-2-phenyl-5H-imidazo(4,5-c)pyridine
CID 10406442
5-[(4-Bromophenyl)methyl]-2-(2-pyridyl)imidazo[4,5-c]pyridine
CID 10451453
5-[(4-Bromophenyl)methyl]-2-(m-tolyl)imidazo[4,5-c]pyridine
CID 11740366
5-[(4-Bromophenyl)methyl]-2-(o-tolyl)imidazo[4,5-c]pyridine
CID 16077340

Frequently Asked Questions

What is the IUPAC name of 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine?
The IUPAC name of 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine (CID 10361780) is 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine is Brc1ccc(Cn2ccc3nc(-c4cccs4)nc-3c2)cc1.
What is the InChIKey of 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine?
The InChIKey is MJZIGSVUFVWPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrN3S/c18-13-5-3-12(4-6-13)10-21-8-7-14-15(11-21)20-17(19-14)16-2-1-9-22-16/h1-9,11H,10H2.
What are the key properties of 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine?
5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine has a molecular weight of 370.28 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-bromophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-c]pyridine is sourced from PubChem (CID 10361780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).