CAS 1186195-62-9|IKK-16

Introduction：Basic information about CAS 1186195-62-9|IKK-16, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. IKK-16 BiologicalActivity
3. Chemical & Physical Properties
4. Synonyms

Common Name	IKK-16
CAS Number	1186195-62-9	Molecular Weight	520.09
Density	/	Boiling Point	/
Molecular Formula	C₂₈H₃₀ClN₅OS	Melting Point	/
MSDS	/	Flash Point	/

Names

Name	[4-[(4-Benzo[b]thien-2-yl-2-pyrimidinyl)amino]phenyl][4-(1-pyrrolidinyl)-1-piperidinyl]-methanone hydrochloride (1:1)
Synonym	More Synonyms

IKK-16 BiologicalActivity

Description	IKK 16 hydrochloride is a selective IκB kinase (IKK) inhibitor for IKK2, IKK complex and IKK1 with IC50s of 40 nM, 70 nM and 200 nM, respectively[1]. IKK16 also inhibits leucine-rich repeat kinase-2 (LRRK2) with an IC50 of 50 nM[2].
Related Catalog	Signaling Pathways >>NF-κB >>IKKSignaling Pathways >>Autophagy >>LRRK2Research Areas >>Inflammation/Immunology
Target	IKK2:40 nM (IC50) IKK1:200 nM (IC50) IKK:70 nM (IC50) LRRK2:50 nM (IC50)
References	[1]. Waelchli R, et al. Design and preparation of 2-benzamido-pyrimidines as inhibitors of IKK. Bioorg Med Chem Lett. Bioorg Med Chem Lett. 2006 Jan 1;16(1):108-12. [2]. Hermanson SB, et al. Screening for novel LRRK2 inhibitors using a high-throughput TR-FRET cellular assay for LRRK2 Ser935 phosphorylation. PLoS One. 2012;7(8):e43580.

Chemical & Physical Properties

Molecular Formula	C₂₈H₃₀ClN₅OS
Molecular Weight	520.09
Exact Mass	519.185974
InChIKey	XFVDIVQCZWDBCW-UHFFFAOYSA-N
SMILES	Cl.O=C(c1ccc(Nc2nccc(-c3cc4ccccc4s3)n2)cc1)N1CCC(N2CCCC2)CC1

Synonyms

(4-{[4-(1-Benzothiophen-2-yl)pyrimidin-2-yl]amino}phenyl)[4-(pyrrolidin-1-yl)piperidin-1-yl]methanone hydrochloride (1:1)

Methanone, [4-[(4-benzo[b]thien-2-yl-2-pyrimidinyl)amino]phenyl][4-(1-pyrrolidinyl)-1-piperidinyl]-, hydrochloride (1:1)

(4-{[4-(1-Benzothiophen-2-yl)-2-pyrimidinyl]amino}phenyl)[4-(1-pyrrolidinyl)-1-piperidinyl]methanone hydrochloride (1:1)

IKK-16

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