PSN632408 - Moligand™,≥98% , Agonist of GPR119, CAS No.857652-30-3, Agonist of GPR119

CAS: 857652-30-3 Cat. No.: P612998 Molecular Weight: 360.41

GRADE & PURITY Moligand™, ≥98%

Synonyms

BBL103893 | EN300-18423838 | Tert-butyl 4-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]piperidine-1-carboxylate | AKOS027257475 | Q7120734 | SR-01000946276 | Z217301086 | BDBM50013915 | MS-25699 | 1-Piperidinecarboxylic acid, 4-((3-(4-pyridinyl)-1,2,4-ox

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

PSN632408, a selective GPR119 agonist, shows similar potency to OEA at both recombinant mouse and human GPR119 receptors (EC50=5.6 and 7.9 uM, respectively). PSN632408 can stimulate β-cell replication and improve islet graft function. PSN632408 has the potential for the research of obesity and related metabolic disorders.

Specifications

Synonyms

BBL103893 | EN300-18423838 | Tert-butyl 4-[(3-pyridin-4-yl-1, 2, 4-oxadiazol-5-yl)methoxy]piperidine-1-carboxylate | AKOS027257475 | Q7120734 | SR-01000946276 | Z217301086 | BDBM50013915 | MS-25699 | 1-Piperidinecarboxylic acid, 4-((3-(4-pyridinyl)-1, 2, 4-ox

Specifications & Purity

Moligand™, ≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of GPR119

Purity

≥98%

Names and Identifiers

• Canonical Smiles: O=C(N1CCC(CC1)OCc1onc(n1)c1ccncc1)OC(C)(C)C
• IUPAC Name: tert-butyl 4-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]piperidine-1-carboxylate
• InChIKey: LHZWKWCEAXQUMX-UHFFFAOYSA-N
• INCHI: 1S/C18H24N4O4/c1-18(2,3)25-17(23)22-10-6-14(7-11-22)24-12-15-20-16(21-26-15)13-4-8-19-9-5-13/h4-5,8-9,14H,6-7,10-12H2,1-3H3
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCC(CC1)OCC2=NC(=NO2)C3=CC=NC=C3
• Molecular Weight: 360.41

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Piperidines
      • Subclass Piperidinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Piperidines
• Subclass: Piperidinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Piperidinecarboxylic acids
• Alternative Parents: Pyridines and derivatives Heteroaromatic compounds Carbamate esters 1,2,4-oxadiazoles Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Piperidinecarboxylic acid - Pyridine - 1,2,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Carbamic acid ester - Dialkyl ether - Ether - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as piperidinecarboxylic acids. These are compounds containing a piperidine ring which bears a carboxylic acid group.
• 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

Associated Targets(Human)

GPR119 Tclin Glucose-dependent insulinotropic receptor (1 Activities)

Discover Target: GPR119

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

Associated Targets(non-human)

Faah Anandamide amidohydrolase (3907 Activities)

Discover Target: Faah

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

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 360.400 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 360.18 Da
• Monoisotopic Mass: 360.18 Da
• Topological Polar Surface Area: 90.600 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 457.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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