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MK-886

CAT: 0804-HY-14166-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-14166-01Size:1 mg
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Description
MK-886 (L 663536) is a potent, cell-permeable and orally active FLAP (IC50 of 30 nM) and leukotriene biosynthesis (IC50s of 3 nM and 1.1 μM in intact leukocytes and human whole blood, respectively) inhibitor. MK-886 is also a non-competitive PPARα antagonist and can induce apoptosis[1][2][3].
CAS Number
118414-82-7
Product Name Alternative
L 663536
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Apoptosis; FLAP; Leukotriene Receptor; PPAR
Type
Reference compound
Related Pathways
Apoptosis; Cell Cycle/DNA Damage; GPCR/G Protein; Immunology/Inflammation; Metabolic Enzyme/Protease; Vitamin D Related/Nuclear Receptor
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/MK-886.html
Concentration
10mM
Purity
99.87
Solubility
DMSO : 75 mg/mL (ultrasonic)
Smiles
CC(C)C1=CC=C(N(CC2=CC=C(Cl)C=C2)C(CC(C)(C(O)=O)C)=C3SC(C)(C)C)C3=C1
Molecular Formula
C27H34ClNO2S
Molecular Weight
472.08
Precautions
H302, H315, H319, H335
References & Citations
[1]Kehrer JP et al. Inhibition of peroxisome-proliferator-activated receptor (PPAR) alpha by MK886. Biochem J. 2001 Jun 15.|[2]Gillard J et al. L-663,536 (MK-886) (3-[1- (4-chlorobenzyl) -3-t-butyl-thio-5-isopropylindol-2-yl]-2,2 - dimethylpropanoic acid), a novel, orally active leukotriene biosynthesis inhibitor. Can J Physiol Pharmacol. 1989 May;67 (5) :456-64.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
Phase 2

Chemical Information

MK 886

3-[3-(tert-butylsulfanyl)-1-(4-chlorobenzyl)-5-(propan-2-yl)-1H-indol-2-yl]-2,2-dimethylpropanoic acid is a member of the class of indoles that is 1H-indole substituted by a isopropyl group at position 5, a tert-butylsulfanediyl group at position 3, a 4-chlorobenzyl group at position 1 and a 2-carboxy-2-methylpropyl group at position 2. It acts as an inhibitor of arachidonate 5-lipoxygenase. It has a role as an antineoplastic agent, a leukotriene antagonist and an EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor. It is a member of indoles, a monocarboxylic acid, an aryl sulfide and a member of monochlorobenzenes.

CAS Number118414-82-7
PubChem CID3651377
IUPAC Name3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-propan-2-ylindol-2-yl]-2,2-dimethylpropanoic acid
Molecular FormulaC27H34ClNO2S
Molecular Weight472.1
XLogP7.6
Topological Polar Surface Area67.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count32
Formal Charge0
Complexity638
SMILES
CC(C)C1=CC2=C(C=C1)N(C(=C2SC(C)(C)C)CC(C)(C)C(=O)O)CC3=CC=C(C=C3)Cl
InChI
InChI=1S/C27H34ClNO2S/c1-17(2)19-10-13-22-21(14-19)24(32-26(3,4)5)23(15-27(6,7)25(30)31)29(22)16-18-8-11-20(28)12-9-18/h8-14,17H,15-16H2,1-7H3,(H,30,31)
InChIKey
QAOAOVKBIIKRNL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MK 886
CAS: 118414-82-7
CID: 3651377
Formula: C27H34ClNO2S
MW: 472.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight472.1
XLogP37.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass471.1998782
Monoisotopic Mass471.1998782
Topological Polar Surface Area67.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity638
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
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MBS131098-01MK 886

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