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3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-imidazo[4,5-b]pyridine

3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-imidazo[4,5-b]pyridine

Inquiry

Molecular Formula:

C13H18BN3O2

Molecular Weight:

259.12

CAS Number:

1257554-02-1

Catalog Number:

1257554-02-1

Product Information

Molecular Formula:

C13H18BN3O2

Molecular Weight:

259.12

Description

3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-imidazo[4,5-b]pyridine is an extensively investigated biomedical compound. It holds promise as an active pharmaceutical ingredient to combat diverse ailments.

Synonyms

3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[4,5-b]pyridine; 3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-imidazo[4,5-b]pyridine; 1257554-02-1; AC1Q3Z2I; SCHEMBL2035636; CTK6I3410

IUPAC Name

3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[4,5-b]pyridine

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N=C2)N(C=N3)C

InChI

InChI=1S/C13H18BN3O2/c1-12(2)13(3,4)19-14(18-12)9-6-10-11(15-7-9)17(5)8-16-10/h6-8H,1-5H3

InChI Key

NPIHDNDJLVIFGB-UHFFFAOYSA-N

Flash Point

Not applicable

Purity

95%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

259.1492070 g/mol

Monoisotopic Mass

259.1492070 g/mol

Topological Polar Surface Area

49.2Å²

Heavy Atom Count

Formal Charge

Complexity

348

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
US-2020207758-A1	3-(1h-pyrazol-4-yl)pyridine allosteric modulators of the m4 muscarinic acetylcholine receptor	2017-06-27
WO-2019000236-A1	ALLOSTERIC MODULATORS OF 3- (1H-PYRAZOL-4-YL) PYRIDINE FROM THE M4 ACETYLCHOLINE MUSCARINIC RECEPTOR	2017-06-27
US-11149036-B2	3-(1H-pyrazol-4-yl)pyridine allosteric modulators of the M4 muscarinic acetylcholine receptor	2017-06-27
EA-037563-B1	NEW (HETERO) ARYL-SUBSTITUTED PIPERIDINYL DERIVATIVES, METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM	2016-12-28
EP-3468971-B1	New (hetero)aryl-substituted-piperidinyl derivatives, a process for their preparation and pharmaceutical compositions containing them	2016-06-10
KR-102003532-B1	Novel (hetero) aryl-substituted-piperidinyl derivatives, methods for their preparation and pharmaceutical compositions containing them	2016-06-10
KR-20190017032-A	Novel (hetero) aryl-substituted-piperidinyl derivatives, methods for their preparation and pharmaceutical compositions containing them	2016-06-10
US-10654849-B2	(Hetero)aryl-substituted-piperidinyl derivatives, a process for their preparation and pharmaceutical compositions containing them	2016-06-10
US-2019144449-A1	(hetero)aryl-substituted-piperidinyl derivatives, a process for their preparation and pharmaceutical compositions containing them	2016-06-10

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-imidazo[4,5-b]pyridine

Product Information

Computed Properties

Patents

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