Imidazo[1,2-a]pyridine - CAS 274-76-0

Catalog:	BB019583
Product Name:	Imidazo[1,2-a]pyridine
CAS:	274-76-0
Synonyms:	imidazo[1,2-a]pyridine

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Computed Properties

IUPAC Name:	imidazo[1,2-a]pyridine
Description:	Imidazo[1,2-a]pyridine (CAS# 274-76-0) is one of four imidazopyridine isomers. Imidazopyridine derivatives possess activity as inhibitors of target enzymes and have medicinal and pharmaceutical applications and are used as herbicides and fungicides.
Molecular Weight:	118.14
Molecular Formula:	C7H6N2
Canonical SMILES:	C1=CC2=NC=CN2C=C1
InChI:	InChI=1S/C7H6N2/c1-2-5-9-6-4-8-7(9)3-1/h1-6H
InChI Key:	UTCSSFWDNNEEBH-UHFFFAOYSA-N
Boiling Point:	103 °C (1 mmHg)
Purity:	97 %
Density:	1.165 g/cm³
MDL:	MFCD00005553
LogP:	1.33430

Publication Number	Title	Priority Date
WO-2021124172-A1	3-(5-methoxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and uses thereof	20191218
WO-2021127265-A1	Compounds and probes for imaging huntingtin protein	20191218
WO-2021127278-A1	Irak degraders and uses thereof	20191217
WO-2021127283-A2	Irak degraders and uses thereof	20191217
WO-2021120741-A1	Metal complex and application thereof	20191216

PMID	Publication Date	Title	Journal
32069401	20200326	Design, Synthesis, and Biological Evaluation of Imidazo[1,2-a]pyridine Derivatives as Novel PI3K/mTOR Dual Inhibitors	Journal of medicinal chemistry
28075132	20170223	Discovery of Imidazo[1,2-a]pyridine Ethers and Squaramides as Selective and Potent Inhibitors of Mycobacterial Adenosine Triphosphate (ATP) Synthesis	Journal of medicinal chemistry
26867485	20160315	Design, synthesis and biological evaluation of imidazo[2,1-b]thiazole and benzo[d]imidazo[2,1-b]thiazole derivatives as Mycobacterium tuberculosis pantothenate synthetase inhibitors	Bioorganic & medicinal chemistry
23867166	20130901	Synthesis and structure activity relationship of imidazo[1,2-a]pyridine-8-carboxamides as a novel antimycobacterial lead series	Bioorganic & medicinal chemistry letters
23147077	20121215	Design and biological evaluation of imidazo[1,2-a]pyridines as novel and potent ASK1 inhibitors	Bioorganic & medicinal chemistry letters

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	118.053098200
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	118.053098200
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8