PI 828 - ≥99%(HPLC) , CAS No.942289-87-4

CAS: 942289-87-4 Cat. No.: P288720 Fórmula: C₁₉H₁₈N₂O₃ Peso molecular: 322.36 PubChem CID: 25181195

GRADE & PURITY ≥99%(HPLC)

Synonyms

2-(4-Morpholinyl)-8-(4-aminopheny)l-4H-1-benzopyran-4-one | LY 294002, 4gamma-NH2 | 8-(4-aminophenyl)-2-morpholino-4H-chromen-4-one | 8-(4-Aminophenyl)-2-(morpholin-4-yl)-4H-chromen-4-one | Q27165404 | DTXSID60648967 | LY294002 4'-NH2 | 8-(4-aminophenyl)-

Storage

Protegido de la luz,Almacenar a -20°C

Shipped In

Hielera + almohadillas de hielo

Descripción general

Descripción del producto：

PI-828 es un inhibidor dual de PI3K y caseína quinasa 2 (CK2) con IC50s de 173 nM, 149 nM, y 1127 nM para p110α, CK2, y CK2α2 en ensayo de lípido quinasa, respectivamente.

Specifications

Sinónimos

2-(4-Morpholinyl)-8-(4-aminopheny)l-4H-1-benzopyran-4-one | LY 294002, 4gamma-NH2 | 8-(4-aminophenyl)-2-morpholino-4H-chromen-4-one | 8-(4-Aminophenyl)-2-(morpholin-4-yl)-4H-chromen-4-one | Q27165404 | DTXSID60648967 | LY294002 4'-NH2 | 8-(4-aminophenyl)-

Especificaciones y pureza

≥99%(HPLC)

Mecanismos bioquímicos y fisiológicos

Inhibidor de la PI 3-Kinasa (los valores IC50 son 0,098, 0,183, 0,227 y 1,967μM para p110β, p110α, p110δy p110γrespectivamente) que muestra mayor potencia que elLY 294002(Cat No. 1130). Puede inmovilizarse en una fase sólida.

Condiciones de almacenamiento de almacenamiento

Protegido de la luz,Almacenar a -20°C

Enviado en

Hielera + almohadillas de hielo

Tipo de acción

INHIBITOR

Pureza

≥99%(HPLC)

Nombres e identificadores

Pubchem Sid

488200777

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488200777

Sonrisas canónicas

C1COCCN1C2=CC(=O)C3=C(O2)C(=CC=C3)C4=CC=C(C=C4)N

IUPAC Name

8-(4-aminophenyl)-2-morpholin-4-ylchromen-4-one

InChIKey

WUKMIBOGGXMBAC-UHFFFAOYSA-N

INCHI

1S/C19H18N2O3/c20-14-6-4-13(5-7-14)15-2-1-3-16-17(22)12-18(24-19(15)16)21-8-10-23-11-9-21/h1-7,12H,8-11,20H2

Isómeros SMILES

C1COCCN1C2=CC(=O)C3=C(O2)C(=CC=C3)C4=CC=C(C=C4)N

PubChem CID

25181195

Peso molecular

322.36

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Benzopyrans
      • Subclass 1-benzopyrans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: Chromones
• Alternative Parents: Dialkylarylamines Aniline and substituted anilines Pyranones and derivatives Morpholines Vinylogous amides Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Chromone - Dialkylarylamine - Aniline or substituted anilines - Pyranone - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyran - Benzenoid - Vinylogous amide - Heteroaromatic compound - Dialkyl ether - Ether - Azacycle - Oxacycle - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Primary amine - Amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.
• 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

Propiedades químicas y físicas

• Solubilidad: Solvent:DMSO, Max Conc. mg/mL: 32.24, Max Conc. mM: 100
• Sensibilidad: light sensitive
• Peso molecular: 322.400 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 322.132 Da
• Monoisotopic Mass: 322.132 Da
• Topological Polar Surface Area: 64.800 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 493.000
• 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