2-Aminoimidazo[4,5-b]pyridine - CAS 132898-03-4

Catalog:	BB007652
Product Name:	2-Aminoimidazo[4,5-b]pyridine
CAS:	132898-03-4
Synonyms:	1H-imidazo[4,5-b]pyridin-2-amine; 1H-imidazo[4,5-b]pyridin-2-amine

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Computed Properties

IUPAC Name:	1H-imidazo[4,5-b]pyridin-2-amine
Description:	2-Aminoimidazo[4,5-b]pyridine (CAS# 132898-03-4) is a useful research chemical compound.
Molecular Weight:	134.14
Molecular Formula:	C6H6N4
Canonical SMILES:	C1=CC2=C(N=C1)N=C(N2)N
InChI:	InChI=1S/C6H6N4/c7-6-9-4-2-1-3-8-5(4)10-6/h1-3H,(H3,7,8,9,10)
InChI Key:	KXQPVJRJUJJWQJ-UHFFFAOYSA-N
Boiling Point:	399.3 °C at 760 mmHg
Density:	1.48 g/cm³
Storage:	Sealed in dry, 2-8 °C
LogP:	0.47020

Publication Number	Title	Priority Date
US-2021085743-A1	Sarracenia-based topical compositions and methods of use thereof	20190924
WO-2020033784-A1	Transglutaminase 2 (tg2) inhibitors	20180810
WO-2019162458-A1	Novel inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases	20180223
EP-3589632-B1	Novel inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases	20180223
US-2020392174-A1	Novel inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases	20180223

PMID	Publication Date	Title	Journal
20869242	20101115	Discovery of 2-aminoimidazopyridine adenosine A(2A) receptor antagonists	Bioorganic & medicinal chemistry letters

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	127
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	134.059246208
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	134.059246208
Rotatable Bond Count:	0
Topological Polar Surface Area:	67.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4