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Diclofenac (Standard)

CAT: 0804-HY-15036R-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-15036R-01Size:10 mg
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Description
Diclofenac (Standard) is the analytical standard of Diclofenac. This product is intended for research and analytical applications. Diclofenac is a potent and nonselective anti-inflammatory agent, acts as a COX inhibitor, with IC50s of 4 and 1.3 nM for human COX-1 and COX-2 in CHO cells[1], and 5.1 and 0.84 μM for ovine COX-1 and COX-2, respectively[2]. Diclofenac induces apoptosis of neural stem cells (NSCs) via the activation of the caspase cascade[3].
CAS Number
15307-86-5
UNSPSC
12352005
Hazard Statement
H301, H361, H372, H411
Target
Apoptosis; COX; Reference Standards
Type
Reference Standards
Related Pathways
Apoptosis; Immunology/Inflammation; Others
Applications
COVID-19-immunoregulation
Field of Research
Inflammation/Immunology; Cancer
Assay Protocol
https://www.medchemexpress.com/diclofenac-standard.html
Purity
99.91
Smiles
O=C(O)CC1=CC=CC=C1NC2=C(Cl)C=CC=C2Cl
Molecular Formula
C14H11Cl2NO2
Molecular Weight
296.15
Precautions
H301, H361, H372, H411
References & Citations
[1]Riendeau D, et al. Biochemical and pharmacological profile of a tetrasubstituted furanone as a highly selective COX-2 inhibitor. Br J Pharmacol. 1997 May;121 (1) :105-17.|[2]Labib MB, et al. Design, synthesis of novel isoindoline hybrids as COX-2 inhibitors: Anti-inflammatory, analgesic activities and docking study. Bioorg Chem. 2018 Oct;80:70-80.|[3]Chiho Kudo, et al. Diclofenac Inhibits Proliferation and Differentiation of Neural Stem Cells. Biochem Pharmacol. 2003 Jul 15;66 (2) :289-95.
Shipping Conditions
Blue Ice
Storage Conditions
4°C, sealed storage, away from light and moisture
Scientific Category
Reference Standards

Chemical Information

Diclofenac

Diclofenac is a monocarboxylic acid consisting of phenylacetic acid having a (2,6-dichlorophenyl)amino group at the 2-position. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic, an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor, a xenobiotic, an environmental contaminant and a drug allergen. It is a dichlorobenzene, a monocarboxylic acid, an amino acid, an aromatic amine and a secondary amino compound. It is functionally related to a phenylacetic acid and a diphenylamine. It is a conjugate acid of a diclofenac(1-).

CAS Number15307-86-5
PubChem CID3033
IUPAC Name2-[2-(2,6-dichloroanilino)phenyl]acetic acid
Molecular FormulaC14H11Cl2NO2
Molecular Weight296.1
XLogP4.4
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity304
SMILES
C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
InChIKey
DCOPUUMXTXDBNB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diclofenac
CAS: 15307-86-5
CID: 3033
Formula: C14H11Cl2NO2
MW: 296.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight296.1
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass295.0166840
Monoisotopic Mass295.0166840
Topological Polar Surface Area49.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity304
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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