AdipoRon - ≥98% , CAS No.924416-43-3

CAS: 924416-43-3 Cat. No.: A275223 Molecular Weight: 428.52 EC Number: 809-728-0

GRADE & PURITY ≥98%

Synonyms

SY103513 | Hydrocupreine, ethyl ester, hydrochloride | 2-(4-Benzoylphenoxy)-N-[1-(phenylmethyl)-4-piperidinyl]acetamide | SW219831-1 | HMS3653C18 | s7365 | SC-396658 | NCGC00370758-10 | AdipoRon | BCP08895 | HY-15848 | EX-A283 | 2-(4-benzoylphenoxy)-N-(1-

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Overview

Store at -20°C. Store under desiccating conditions. The product can be stored for up to 12 months.

Specifications

Synonyms

SY103513 | Hydrocupreine, ethyl ester, hydrochloride | 2-(4-Benzoylphenoxy)-N-[1-(phenylmethyl)-4-piperidinyl]acetamide | SW219831-1 | HMS3653C18 | s7365 | SC-396658 | NCGC00370758-10 | AdipoRon | BCP08895 | HY-15848 | EX-A283 | 2-(4-benzoylphenoxy)-N-(1-

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Adiponectin receptor agonist (K D values are 1.8 and 3.1 μM for AdipoR1 and AdipoR2, respectively). AMPK and PPARα signaling activator. Shows antiobesogenic, antidiabetic and cardioprotective effects in vivo. Orally active.

Storage

Store at -20°C, Desiccated

Shipped In

Ice chest + Ice pads

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

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504768446
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504768446
• Canonical Smiles: C1CN(CCC1NC(=O)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)CC4=CC=CC=C4
• IUPAC Name: 2-(4-benzoylphenoxy)-N-(1-benzylpiperidin-4-yl)acetamide
• InChIKey: SHHUPGSHGSNPDB-UHFFFAOYSA-N
• INCHI: 1S/C27H28N2O3/c30-26(28-24-15-17-29(18-16-24)19-21-7-3-1-4-8-21)20-32-25-13-11-23(12-14-25)27(31)22-9-5-2-6-10-22/h1-14,24H,15-20H2,(H,28,30)
• Isomeric SMILES: C1CN(CCC1NC(=O)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)CC4=CC=CC=C4
• Molecular Weight: 428.52
• Reaxy-Rn: 26897425
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=26897425&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzophenones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: N-benzylpiperidines Diphenylmethanes Aryl-phenylketones Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Benzoyl derivatives Alkyl aryl ethers Aralkylamines Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Benzophenone - Aryl-phenylketone - Diphenylmethane - N-benzylpiperidine - Benzylpiperidine - Phenoxy compound - Benzoyl - Benzylamine - Aryl ketone - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Piperidine - Amino acid or derivatives - Carboxamide group - Ketone - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
• 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)

ADIPOR1 Tbio Adiponectin receptor protein 1 (1 Activities)

Discover Target: ADIPOR1

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

ADIPOR2 Tbio Adiponectin receptor protein 2 (1 Activities)

Discover Target: ADIPOR2

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

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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

Mus musculus (284745 Activities)

Explore this target

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

RAW264.7 (28094 Activities)

Explore this target

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

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in ethanol to 100 mM and in DMSO to 100 mM
• Sensitivity: light sensitive
• Molecular Weight: 428.500 g/mol
• XLogP3: 4.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 428.21 Da
• Monoisotopic Mass: 428.21 Da
• Topological Polar Surface Area: 58.600 Ų
• Heavy Atom Count: 32
• Formal Charge: 0
• Complexity: 582.000
• 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