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

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Product description：

PI-828 is a dual PI3K and casein kinase 2 (CK2) inhibitor with IC50s of 173 nM, 149 nM, and 1127 nM for p110α, CK2, and CK2α2 in lipid kinase assay, respectively.

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)-

Especificações e pureza

≥99%(HPLC)

Mecanismos bioquímicos e fisiológicos

PI 3-Kinase inhibitor (IC50values are 0.098, 0.183, 0.227 and 1.967μM for p110β, p110α, p110δand p110γrespectively) that displays higher potency thanLY 294002(Cat No. 1130). Can be immobilized onto a solid phase.

Condições de armazenamento de armazenamento

Protected from light,Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Tipo de ação

INHIBITOR

Pureza

≥99%(HPLC)

Nomes e identificadores

Pubchem Sid

488200777

Pubchem Sid Url

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

Sorrisos canónicos

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

SMILES isoméricas

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
    • Classe Benzopyrans
      • Subclass 1-benzopyrans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: 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
• Descrição: 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

Propriedades químicas e físicas

• Solubilidade: Solvent:DMSO, Max Conc. mg/mL: 32.24, Max Conc. mM: 100
• Sensibilidade: 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