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TUG-499

CAT: 0013-GTR19211876-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211876-01Size:2 mg
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Description
TUG-499 is a potent and selective agonist for the free fatty acid receptor 1 (FFAR1/GPR40) with an EC50 of 7.39 nM. It exhibits high selectivity over related receptors like FFA2, FFA3, and PPARγ. This compound is a valuable research tool for investigating FFAR1-mediated insulin secretion in both in vitro and in vivo models of type 2 diabetes.
CAS Number
1206629-08-4
Product Name Alternative
PPARγ, TUG 499, TUG499, TUG-499, FFA2, GPR40
Field of Research
Metabolism Research, Molecular Biology, Pharmacology & Drug Discovery
Purity
99.59% (May vary between batches)
Solubility
DMSO:22.5 mg/mL (70.28 mM) ;10% DMSO+90% Corn Oil:2 mg/mL (6.25 mM)
Smiles
C (#CC1=CC=C (CCC (O) =O) C=C1) C=2C=C (Cl) N=C (Cl) C2
Molecular Formula
C16H11Cl2NO2
Molecular Weight
320.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-(4-((2,6-Dichloropyridin-4-yl)ethynyl)phenyl)propanoic Acid

a free fatty acid receptor 1 (FFA1) agonist; structure in first source

CAS Number1206629-08-4
PubChem CID54669771
IUPAC Name3-[4-[2-(2,6-dichloro-4-pyridinyl)ethynyl]phenyl]propanoic acid
Molecular FormulaC16H11Cl2NO2
Molecular Weight320.2
XLogP4.6
Topological Polar Surface Area50.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity410
SMILES
C1=CC(=CC=C1CCC(=O)O)C#CC2=CC(=NC(=C2)Cl)Cl
InChI
InChI=1S/C16H11Cl2NO2/c17-14-9-13(10-15(18)19-14)6-5-11-1-3-12(4-2-11)7-8-16(20)21/h1-4,9-10H,7-8H2,(H,20,21)
InChIKey
GCWBKYDSSJIRNJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(4-((2,6-Dichloropyridin-4-yl)ethynyl)phenyl)propanoic Acid
CAS: 1206629-08-4
CID: 54669771
Formula: C16H11Cl2NO2
MW: 320.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight320.2
XLogP34.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass319.0166840
Monoisotopic Mass319.0166840
Topological Polar Surface Area50.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity410
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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