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DiMNF

CAT: 0804-HY-103222-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-103222-01Size:5 mg
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Description
DiMNF (3',4'-Dimethoxy-αNF) is a selective aryl hydrocarbon receptor (AHR) modulator. DiMNF is a competitive AHR ligand (IC50 = 21 nM) with apparent antagonistic activity. DiMNF can be used as an anti-inflammatory agent[1].
CAS Number
14756-24-2
Product Name Alternative
3',4'-Dimethoxy-αNF
UNSPSC
12352005
Hazard Statement
H301
Target
Aryl Hydrocarbon Receptor
Type
Reference compound
Related Pathways
Immunology/Inflammation
Applications
COVID-19-immunoregulation
Field of Research
Inflammation/Immunology
Assay Protocol
https://www.medchemexpress.com/dimnf.html
Concentration
10mM
Purity
98.46
Solubility
DMSO : 12.5 mg/mL (ultrasonic; warming; heat to 70°C)
Smiles
O=C1C2=CC=C3C=CC=CC3=C2OC(C4=CC=C(OC)C(OC)=C4)=C1
Molecular Formula
C21H16O4
Molecular Weight
332.35
Precautions
H301
References & Citations
[1]Murray IA, et al. Suppression of cytokine-mediated complement factor gene expression through selective activation of the Ah receptor with 3',4'-dimethoxy-α-naphthoflavone. Mol Pharmacol. 2011 Mar;79 (3) :508-19.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

3',4'-Dimethoxy-alpha-naphthoflavone

activated Ah receptor; structure in first source

CAS Number14756-24-2
PubChem CID276138
IUPAC Name2-(3,4-dimethoxyphenyl)benzo[h]chromen-4-one
Molecular FormulaC21H16O4
Molecular Weight332.3
XLogP4.4
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity528
SMILES
COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C4=CC=CC=C4C=C3)OC
InChI
InChI=1S/C21H16O4/c1-23-18-10-8-14(11-20(18)24-2)19-12-17(22)16-9-7-13-5-3-4-6-15(13)21(16)25-19/h3-12H,1-2H3
InChIKey
QDZQDIUUJDAORK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3',4'-Dimethoxy-alpha-naphthoflavone
CAS: 14756-24-2
CID: 276138
Formula: C21H16O4
MW: 332.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.3
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass332.10485899
Monoisotopic Mass332.10485899
Topological Polar Surface Area44.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity528
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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