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TP-051

CAT: 0013-GTR19211433-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211433-01Size:1 mg
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Description
TP-051 is a potent and selective FFAR1 agonist with a Ki of 16 nM for human FFAR1. It enhances glucose-stimulated insulin secretion in vitro and serves as a key chemical probe for investigating FFAR1-mediated pathways in type 2 diabetes and metabolic disease research.
CAS Number
858097-86-6
Product Name Alternative
TP051, TP-051, TP 051
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Purity
98.91% (May vary between batches)
Smiles
O=C (O) CCC1=CC=C (OCC2=CC=CC (=C2) C3=C (C=C (OC4CCS (=O) (=O) CC4) C=C3C) C) C=C1F
Molecular Formula
C29H31FO6S
Molecular Weight
526.62
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-[4-[[3-[4-(1,1-Dioxothian-4-yl)oxy-2,6-dimethylphenyl]phenyl]methoxy]-2-fluorophenyl]propanoic acid
CAS Number858097-86-6
PubChem CID11203294
IUPAC Name3-[4-[[3-[4-(1,1-dioxothian-4-yl)oxy-2,6-dimethylphenyl]phenyl]methoxy]-2-fluorophenyl]propanoic acid
Molecular FormulaC29H31FO6S
Molecular Weight526.6
XLogP5.5
Topological Polar Surface Area98.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count37
Formal Charge0
Complexity818
SMILES
CC1=CC(=CC(=C1C2=CC=CC(=C2)COC3=CC(=C(C=C3)CCC(=O)O)F)C)OC4CCS(=O)(=O)CC4
InChI
InChI=1S/C29H31FO6S/c1-19-14-26(36-24-10-12-37(33,34)13-11-24)15-20(2)29(19)23-5-3-4-21(16-23)18-35-25-8-6-22(27(30)17-25)7-9-28(31)32/h3-6,8,14-17,24H,7,9-13,18H2,1-2H3,(H,31,32)
InChIKey
RPAHCZZXEGWBDL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[4-[[3-[4-(1,1-Dioxothian-4-yl)oxy-2,6-dimethylphenyl]phenyl]methoxy]-2-fluorophenyl]propanoic acid
CAS: 858097-86-6
CID: 11203294
Formula: C29H31FO6S
MW: 526.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight526.6
XLogP35.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass526.18253804
Monoisotopic Mass526.18253804
Topological Polar Surface Area98.3 Ų
Heavy Atom Count37
Formal Charge0
Complexity818
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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