GPR40/FFAR1 modulator 1

CAT: 0013-GTR19177299-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19177299-02Size:10 mg

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Description

This small molecule is a dual-acting agonist and allosteric modulator of the Gq-coupled GPR40/FFAR1 receptor. It is a valuable research tool for investigating receptor pharmacology and has been utilized in both in vitro and in vivo studies exploring metabolic diseases like type 2 diabetes.

CAS Number

874755-26-7

Product Name Alternative

Inhibitor, GPR40/FFAR1 modulator 1, GPR-40/FFAR1 modulator 1, GPR40/FFAR1, FFAR, Free Fatty Acid Receptor, inhibit

Field of Research

Metabolism Research, Pharmacology & Drug Discovery

Purity

99.70% (May vary between batches)

Solubility

10% DMSO+90% Saline:2 mg/mL (5.14 mM) ; DMSO:30 mg/mL (77.04 mM)

Smiles

Cc1ccccc1Nc1nc (N) nc (COc2ccc3c (C) cc (=O) oc3c2) n1

Molecular Formula

C21H19N5O3

Molecular Weight

389.41

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

GPR40/FFAR1 modulator 1

CAS Number	874755-26-7
PubChem CID	8852666
IUPAC Name	7-[[4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methoxy]-4-methylchromen-2-one
Molecular Formula	C21H19N5O3
Molecular Weight	389.4
XLogP	3.3
Topological Polar Surface Area	112
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Heavy Atom Count	29
Formal Charge	0
Complexity	615

SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=CC4=C(C=C3)C(=CC(=O)O4)C

InChI

InChI=1S/C21H19N5O3/c1-12-5-3-4-6-16(12)23-21-25-18(24-20(22)26-21)11-28-14-7-8-15-13(2)9-19(27)29-17(15)10-14/h3-10H,11H2,1-2H3,(H3,22,23,24,25,26)

InChIKey

WCRLDDWRDAIHGO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 874755-26-7

CID: 8852666

Formula: C21H19N5O3

MW: 389.4

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	389.4
XLogP3	3.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	389.14878949
Monoisotopic Mass	389.14878949
Topological Polar Surface Area	112 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	615
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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GPR40/FFAR1 modulator 1

Chemical Information

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