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MN 64 - 10mM in DMSO, high purity , CAS No.92831-11-3
Basic Description
Synonyms
mn-64 | 92831-11-3 | MN 64 | 4'-Isopropylflavone | 2-(4-Isopropylpheny)-4H-chroMen-4-one | 2-(4-propan-2-ylphenyl)chromen-4-one | 2-(4-isopropylphenyl)-4H-chromen-4-one | 2-[4-(1-Methylethyl)phenyl]-4H-1-benzopyran-4-one | CHEMBL2431867 | 2-[4-(propan-2-yl)phenyl]-4H-chrom
Specifications & Purity
10mM in DMSO
Biochemical and Physiological Mechanisms
MN-64 is a potent inhibitor of TNKS1 and TNKS2 with IC50 value of 6 and 72 nM, respectively.
Storage Temp
Store at -80°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description
Information
MN 64 MN-64 is a potent inhibitor of TNKS1 and TNKS2 with IC50 value of 6 and 72 nM, respectively.
Targets
TNKS1 ; TNKS2 6 nM; 72 nM
In vitro
MN-64 inhibits WNT/β-catenin signaling-dependent Super-TopFlash (STF) luciferase activity.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavones
Intermediate Tree Nodes
Not available
Direct Parent
Flavones
Alternative Parents
Chromones Bicyclic monoterpenoids Aromatic monoterpenoids Phenylpropanes Cumenes Pyranones and derivatives Heteroaromatic compounds Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavone - Chromone - P-cymene - Aromatic monoterpenoid - Benzopyran - Bicyclic monoterpenoid - Monoterpenoid - 1-benzopyran - Cumene - Phenylpropane - Pyranone - Benzenoid - Monocyclic benzene moiety - Pyran - Heteroaromatic compound - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavones. These are flavonoids with a structure based on the backbone of 2-phenylchromen-4-one (2-phenyl-1-benzopyran-4-one).
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Product Properties
ALogP
4.33
hba_count
2
Rotatable Bond
2
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
2-(4-propan-2-ylphenyl)chromen-4-one
INCHI
InChI=1S/C18H16O2/c1-12(2)13-7-9-14(10-8-13)18-11-16(19)15-5-3-4-6-17(15)20-18/h3-12H,1-2H3
InChIKey
PYTOHIUBXSJKQH-UHFFFAOYSA-N
Smiles
CC(C)C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2
Isomeric SMILES
CC(C)C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2
Molecular Weight
264.32
Reaxy-Rn
5269408
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5269408&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
DMSO(mg / mL) Max Solubility
53
DMSO(mM) Max Solubility
200.514527845036
Water(mg / mL) Max Solubility
＜1
Molecular Weight
264.300 g/mol
XLogP3
4.700
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
264.115 Da
Monoisotopic Mass
264.115 Da
Topological Polar Surface Area
26.300 Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
388.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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