PNU 74654 - ≥98% , CAS No.113906-27-7

CAS: 113906-27-7 Cat. No.: P276267 Fórmula: C₁₉H₁₆N₂O₃ Peso molecular: 320.34 Número EC: 631-232-6 PubChem CID: 9836739

GRADE & PURITY ≥98%

Synonyms

HMS3413P04 | HY-101130 | PNU74654 | PNU-74654 | J-003040 | NSC755984 | NSC-755984 | CCG-208115 | N-[(E)-(5-Methylfuran-2-yl)methylideneamino]-2-phenoxybenzamide | SCHEMBL3514174 | BDBM50436058 | AC-33054 | PNU 74654 | 2-Phenoxybenzoic acid-[(5-methyl-2-fu

Storage

Conservar a -20°C,Desecado

Shipped In

Hielera + almohadillas de hielo

Descripción general

Almacenar a -20°C. Almacenar en condiciones de desecación. El producto puede almacenarse hasta 12 meses.

aplicación：

PNU-74654 se ha utilizado

como inhibidor de la señalización de β-catenina para estudiar sus efectos sobre la diferenciación del cartílago en embriones de Sepia sp

como inhibidor de la señalización Wnt para estudiar sus efectos sobre la inhibición de la glucógeno sintasa quinasa 3β (GSK-3β) en líneas celulares de cáncer de próstata

como inhibidor de la señalización Wnt para estudiar sus efectos sobre la proliferación celular inducida por leptina en células de cáncer de mama

Specifications

Sinónimos

HMS3413P04 | HY-101130 | PNU74654 | PNU-74654 | J-003040 | NSC755984 | NSC-755984 | CCG-208115 | N-[(E)-(5-Methylfuran-2-yl)methylideneamino]-2-phenoxybenzamide | SCHEMBL3514174 | BDBM50436058 | AC-33054 | PNU 74654 | 2-Phenoxybenzoic acid-[(5-methyl-2-fu

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

Bloqueante de la vía de señalización Wnt. Inhibe la vía Wnt/β-catenina. Bloquea la interacción proteína-proteína entre β-catenina y TCF. PNU-74654 inhibe la vía Wnt-β-catenina bloqueando la interacción entre β-catenina y TCF (T cell f

Condiciones de almacenamiento de almacenamiento

Conservar a -20°C,Desecado

Enviado en

Hielera + almohadillas de hielo

Nota

Siempre que sea posible, prepare y utilice las soluciones el mismo día. No obstante, si necesita preparar soluciones madre con antelación, le recomendamos que almacene la solución como alícuotas en viales herméticamente cerrados a -20°C. Por lo general, podrán utilizarse durante un mes. Antes de su uso, y antes de abrir el vial, le recomendamos que deje que el producto se equilibre a temperatura ambiente durante al menos 1 hora. ¿Necesita más consejos sobre solubilidad, uso y manipulación? Visite nuestra página de preguntas frecuentes (FAQ) para obtener más información.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504764940
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764940
• Sonrisas canónicas: CC1=CC=C(O1)C=NNC(=O)C2=CC=CC=C2OC3=CC=CC=C3
• IUPAC Name: N-[(E)-(5-methylfuran-2-yl)methylideneamino]-2-phenoxybenzamide
• InChIKey: JJEDWBQZCRESJL-DEDYPNTBSA-N
• INCHI: 1S/C19H16N2O3/c1-14-11-12-16(23-14)13-20-21-19(22)17-9-5-6-10-18(17)24-15-7-3-2-4-8-15/h2-13H,1H3,(H,21,22)/b20-13+
• Isómeros SMILES: CC1=CC=C(O1)/C=N/NC(=O)C2=CC=CC=C2OC3=CC=CC=C3
• PubChem CID: 9836739
• Peso molecular: 320.34

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Diphenylethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylethers
• Alternative Parents: Diarylethers Benzoic acids and derivatives Phenoxy compounds Phenol ethers Benzoyl derivatives Heteroaromatic compounds Furans Oxacyclic compounds Carboxylic acids and derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Diphenylether - Diaryl ether - Benzoic acid or derivatives - Benzoyl - Phenoxy compound - Phenol ether - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether 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

Objetivos asociados (humanos)

CTNNB1 Tchem Catenin beta-1 (1 Activities)

Discover Target: CTNNB1

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

CTNNB1 Tchem Catenin beta-1 (517 Activities)

Discover Target: CTNNB1

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

CTNNB1 Tchem TCF4/beta-catenin (616 Activities)

Discover Target: CTNNB1

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

CTNNB1 Tchem TCF4-CTNNB1 complex (25 Activities)

Discover Target: CTNNB1

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

Objetivos asociados (no humanos)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in DMSO to 75 mM
• Peso molecular: 320.300 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 320.116 Da
• Monoisotopic Mass: 320.116 Da
• Topological Polar Surface Area: 63.800 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 434.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

Referencias

1. Fang Lini, Tao Yang, Che Guoying, Yun Yongzi, Ren Min, Liu Yujie.  (2024)  WSB1, as an E3 ligase, restrains myocardial ischemia–reperfusion injury by activating β-catenin signaling via promoting GSK3β ubiquitination.  MOLECULAR MEDICINE,  30  (1): (1-16).  [PMID:38395742] [10.1186/s10020-024-00800-3]

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

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 113906-27-7, the molecular formula is C19H16N2O3, and the molecular weight is 320.34 g/mol. InChIKey JJEDWBQZCRESJL-DEDYPNTBSA-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.