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GPR120 Agonist 2

CAT: 0804-HY-111353-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-111353-01Size:5 mg
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Description
GPR120 Agonist 2 is a GPR120 agonist extracted from patent US 20110313003 A1, example 209.
CAS Number
1234844-11-1
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Free Fatty Acid Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/GPR120_Agonist_2.html
Purity
99.07
Solubility
DMSO : ≥ 50 mg/mL
Smiles
O=C(O)CCC1=CC=C(OCC2=C(OC(C)(C)C3)C3=CC(Cl)=C2)C(C)=C1C
Molecular Formula
C22H25ClO4
Molecular Weight
388.88
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Dong Fang Shi, et al. Gpr120 receptor agonists and uses thereof. US20110313003.
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

GPR120 Agonist 2
CAS Number1234844-11-1
PubChem CID46700745
IUPAC Name3-[4-[(5-chloro-2,2-dimethyl-3H-1-benzofuran-7-yl)methoxy]-2,3-dimethylphenyl]propanoic acid
Molecular FormulaC22H25ClO4
Molecular Weight388.9
XLogP5.1
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity522
SMILES
CC1=C(C=CC(=C1C)OCC2=CC(=CC3=C2OC(C3)(C)C)Cl)CCC(=O)O
InChI
InChI=1S/C22H25ClO4/c1-13-14(2)19(7-5-15(13)6-8-20(24)25)26-12-17-10-18(23)9-16-11-22(3,4)27-21(16)17/h5,7,9-10H,6,8,11-12H2,1-4H3,(H,24,25)
InChIKey
KOHMUAMPZUHGNV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of GPR120 Agonist 2
CAS: 1234844-11-1
CID: 46700745
Formula: C22H25ClO4
MW: 388.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight388.9
XLogP35.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass388.1441370
Monoisotopic Mass388.1441370
Topological Polar Surface Area55.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity522
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