PF-06882961 - Moligand™, ≥99% , Agonist of GLP-1 receptor, CAS No.2230198-02-2, Agonist of GLP-1 receptor

CAS: 2230198-02-2 Cat. No.: P414495 分子式: C₃₁H₃₀FN₅O₄ 分子量: 555.6 PubChem CID: 134611040

GRADE & PURITY Moligand™, ≥99%

Synonyms

PF-06882961|Danuglipron|2230198-02-2|Danuglipron [USAN]|DN9IUI24GP|(S)-2-((4-(6-((4-cyano-2-fluorobenzyl)oxy)pyridin-2-yl)piperidin-1-yl)methyl)-1-(oxetan-2-ylmethyl)-1H-benzo[d]imidazole-6-carboxylic acid|2-[(4-{6-[(4-cyano-2-fluorophenyl)methoxy]pyridin

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

概要

Information

PF-06882961 PF-06882961, a non-peptide agonist, activates the canonical G protein signaling activity only in the Glukagon-like peptide-1 (GLP-1) receptor with Trp33 ECD .

Targets

GLP-1 receptor

In vitro

PF-06882961 stimulates cAMP accumulation in CHO cells expressing both the human and monkey GLP-1Rs with comparable EC50 values. In contrast, PF-06882961 does not increase cAMP levels in cells expressing the mouse, rat, or rabbit GLP-1R.

In vivo

PF-06882961 potentiates glucose-stimulated insulin release and reduces food intake in monkeys.

Cell Research(from reference)

Cell lines：HEK293 cells 

Concentrations：1 μM 

Incubation Time：30 minutes 

Specifications

同義語

PF-06882961 | Danuglipron | 2230198-02-2 | Danuglipron [USAN] | DN9IUI24GP | (S)-2-((4-(6-((4-cyano-2-fluorobenzyl)oxy)pyridin-2-yl)piperidin-1-yl)methyl)-1-(oxetan-2-ylmethyl)-1H-benzo[d]imidazole-6-carboxylic acid | 2-[(4-{6-[(4-cyano-2-fluorophenyl)methoxy]pyridin

仕様と純度

Moligand™, ≥99%

生化学的・生理学的メカニズム

PF-06882961, a non-peptide agonist, activates the canonical G protein signaling activity only in the Glukagon-like peptide-1 (GLP-1) receptor with Trp33^ECD.

保管条件

Store at -20°C

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

等級

Moligand™

アクションタイプ

AGONIST

作用メカニズム

Agonist of GLP-1 receptor

純度

≥99%

製品の性質

• ALogP: 1.4

名前と識別子

• パブケム・シド: 504773175
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/504773175
• カノニカル・スマイル: C1CN(CCC1C2=NC(=CC=C2)OCC3=C(C=C(C=C3)C#N)F)CC4=NC5=C(N4CC6CCO6)C=C(C=C5)C(=O)O
• IUPAC Name: 2-[[4-[6-[(4-cyano-2-fluorophenyl)methoxy]pyridin-2-yl]piperidin-1-yl]methyl]-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid
• InChIKey: HYBAKUMPISVZQP-DEOSSOPVSA-N
• INCHI: 1S/C31H30FN5O4/c32-25-14-20(16-33)4-5-23(25)19-41-30-3-1-2-26(35-30)21-8-11-36(12-9-21)18-29-34-27-7-6-22(31(38)39)15-28(27)37(29)17-24-10-13-40-24/h1-7,14-15,21,24H,8-13,17-19H2,(H,38,39)/t24-/m0/s1
• 異性体SMILES: C1CO[C@@H]1CN2C3=C(C=CC(=C3)C(=O)O)N=C2CN4CCC(CC4)C5=NC(=CC=C5)OCC6=C(C=C(C=C6)C#N)F
• 代替CAS番号: 2230198-02-2
• PubChem CID: 134611040
• 分子量: 555.6

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 分類 Benzimidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Benzimidazoles
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzimidazoles
• Alternative Parents: Benzonitriles Fluorobenzenes Aralkylamines Alkyl aryl ethers Pyridines and derivatives Piperidines N-substituted imidazoles Aryl fluorides Heteroaromatic compounds Trialkylamines Oxetanes Amino acids Oxacyclic compounds Nitriles Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzimidazole - Benzonitrile - Aralkylamine - Halobenzene - Fluorobenzene - Alkyl aryl ether - Benzenoid - Pyridine - Piperidine - N-substituted imidazole - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Heteroaromatic compound - Imidazole - Azole - Amino acid - Tertiary aliphatic amine - Tertiary amine - Oxetane - Amino acid or derivatives - Oxacycle - Azacycle - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

関連ターゲット（人間）

GLP1R Tclin Glucagon-like peptide 1 receptor (1 Activities)

Discover Target: GLP1R

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

KCNH2 Tclin HERG (29587 Activities)

Discover Target: KCNH2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

Discover Target: GLP1R

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

関連ターゲット（非人間）

Mus musculus (284745 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 溶解度: Solubility (25°C) In vitro DMSO: 100 mg/mL (179.98 mM); Ethanol: 100 mg/mL (179.98 mM); Water: Insoluble
• 分子量: 555.600 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 555.228 Da
• Monoisotopic Mass: 555.228 Da
• Topological Polar Surface Area: 114.000 Ų
• Heavy Atom Count: 41
• Formal Charge: 0
• Complexity: 941.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

よくある質問

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2230198-02-2, the molecular formula is C31H30FN5O4, and the molecular weight is 555.6 g/mol. InChIKey HYBAKUMPISVZQP-DEOSSOPVSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.