PluriSIn #2 - ≥98% , CAS No.56563-17-8

CAS: 56563-17-8 Cat. No.: P647953 Formule: C₁₁H₈FN₃O₃ Poids moléculaire: 249.20 PubChem CID: 92451

GRADE & PURITY ≥98%

Synonyms

1-Phenylcarbamoyl-5-fluoroureacil | PluriSIn #2 | 1(2H)-PYRIMIDINECARBOXAMIDE, 5-FLUORO-3,4-DICHLO | 1(2H)-Pyrimidinecarboxamide, 5-fluoro-3,4-dihydro-2,4-dioxo-N-phenyl- | AKOS040755171 | 5-fluoro-2,4-dioxo-N-phenylpyrimidine-1-carboxamide | DTXSID908766

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Vue d’ensemble

PluriSIn #2 is a selective transcriptional inhibitor of topoisomerase II α (TOP2A) . PluriSIn #2 is a compound that selectively eliminates undifferentiated human pluripotent stem cells (hPSCs)

In Vitro

PluriSIn #2 (20 µM; 12 hours) treatment reduces TOP2A expression at the protein level. A 24h exposure of PluriSIn #2 (20 µM) is sufficient to induce massive cell death in hPSCs, but doesn’t affect the viability of various other cell types derived from them. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Western Blot AnalysisCell Line: B153 and HUES9 human pluripotent stem cells (hPSCs) Concentration: 20 µM Incubation Time: 12 hours Result: Reduced TOP2A expression at the protein level.

Form:Solid

IC50& Target:topoisomerase II alpha

Specifications

Synonymes

1-Phenylcarbamoyl-5-fluoroureacil | PluriSIn #2 | 1(2H)-PYRIMIDINECARBOXAMIDE, 5-FLUORO-3,4-DICHLO | 1(2H)-Pyrimidinecarboxamide, 5-fluoro-3,4-dihydro-2,4-dioxo-N-phenyl- | AKOS040755171 | 5-fluoro-2,4-dioxo-N-phenylpyrimidine-1-carboxamide | DTXSID908766

Spécifications et pureté

≥98%

Mécanismes biochimiques et physiologiques

PluriSIn #2 is a selective transcriptional inhibitor of topoisomerase II α (TOP2A) . PluriSIn #2 is a compound that selectively eliminates undifferentiated human pluripotent stem cells (hPSCs).

Conditions de stockage de stockage

Store at 2-8°C,Protected from light,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Type d'action

INHIBITOR

Pureté

≥98%

Noms et identifiants

• Sourires canoniques: C1=CC=C(C=C1)NC(=O)N2C=C(C(=O)NC2=O)F
• IUPAC Name: 5-fluoro-2,4-dioxo-N-phenylpyrimidine-1-carboxamide
• InChIKey: PXXNTSRWKSCFCK-UHFFFAOYSA-N
• INCHI: 1S/C11H8FN3O3/c12-8-6-15(11(18)14-9(8)16)10(17)13-7-4-2-1-3-5-7/h1-6H,(H,13,17)(H,14,16,18)
• Isomères SMILES: C1=CC=C(C=C1)NC(=O)N2C=C(C(=O)NC2=O)F
• CAS alternatif: 56563-17-8
• PubChem CID: 92451
• Poids moléculaire: 249.20

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass N-phenylureas

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: N-phenylureas
• Intermediate Tree Nodes: Not available
• Direct Parent: N-phenylureas
• Alternative Parents: Pyrimidones Halopyrimidines Hydropyrimidines Aryl fluorides Vinylogous amides Heteroaromatic compounds Ureas Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-phenylurea - Pyrimidone - Halopyrimidine - Pyrimidine - Hydropyrimidine - Aryl halide - Aryl fluoride - Heteroaromatic compound - Vinylogous amide - Urea - Carbonic acid derivative - Lactam - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea 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

Propriétés chimiques et physiques

• Solubilité: DMSO : 5 mg/mL (20.06 mM; Need ultrasonic)
• Poids moléculaire: 249.200 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 249.055 Da
• Monoisotopic Mass: 249.055 Da
• Topological Polar Surface Area: 78.500 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 416.000
• 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

Foire aux questions

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 is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

How should this product be stored?

Store at 2–8 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 56563-17-8, the molecular formula is C11H8FN3O3, and the molecular weight is 249.20 g/mol. InChIKey PXXNTSRWKSCFCK-UHFFFAOYSA-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.