PT-2385 - ≥98% , CAS No.1672665-49-4

CAS: 1672665-49-4 Cat. No.: P275651 Formule: C₁₇H₁₂F₃NO₄S Poids moléculaire: 383.34 PubChem CID: 91754484

GRADE & PURITY ≥98%

Synonyms

MK3795 | MK-3795 | Q27456687 | (s)-3-((2,2-difluoro-1-hydroxy-7-(methylsulfonyl)-2,3-dihydro-1h-inden-4-yl)oxy)-5-fluorobenzonitrile | s8352 | NCGC00387306-02 | B4285 | 1672665-49-4 | BDBM373008 | SCHEMBL16555810 | EX-A2855 | NSC787312 | NSC-787312 | 3-{[

Storage

A l'abri de la lumière,A conserver à -20°C,Desséché

Shipped In

Glacière + blocs de glace

Vue d’ensemble

Expédition à température ambiante. Conserver à -20°C. Il est important de noter que ce produit est sensible à l'air et que des impuretés peuvent apparaître à la suite de l'oxydation par l'air. Stocker dans l'obscurité. Conserver dans des conditions de dessiccation.

Specifications

Synonymes

MK3795 | MK-3795 | Q27456687 | (s)-3-((2,2-difluoro-1-hydroxy-7-(methylsulfonyl)-2,3-dihydro-1h-inden-4-yl)oxy)-5-fluorobenzonitrile | s8352 | NCGC00387306-02 | B4285 | 1672665-49-4 | BDBM373008 | SCHEMBL16555810 | EX-A2855 | NSC787312 | NSC-787312 | 3-{[

Spécifications et pureté

≥98%

Mécanismes biochimiques et physiologiques

Inhibiteur puissant et sélectif du facteur inductible par l'hypoxie (HIF-2α) avec une activité antinéoplasique potentielle. Le PT-2385 perturbe sélectivement l'hétérodimérisation de HIF-2α avec HIF-1β. Très efficace pour bloquer la croissance et la prolif

Conditions de stockage de stockage

A l'abri de la lumière,A conserver à -20°C,Desséché

Expédié en

Glacière + blocs de glace

Note

Dans la mesure du possible, les solutions doivent être préparées et utilisées le même jour. Toutefois, si vous devez préparer des solutions de base à l'avance, nous vous recommandons de les conserver sous forme d'aliquotes dans des flacons hermétiques à -20°C. Ces aliquotes sont généralement utilisables pendant un mois. En général, ces solutions peuvent être utilisées pendant un mois. Avant utilisation, et avant d'ouvrir le flacon, nous vous recommandons de laisser votre produit s'équilibrer à température ambiante pendant au moins 1 heure. Besoin de plus de conseils sur la solubilité, l'utilisation et la manipulation ? Veuillez consulter notre page de questions fréquemment posées (FAQ) pour plus de détails.

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 504772655
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504772655
• Sourires canoniques: CS(=O)(=O)C1=C2C(C(CC2=C(C=C1)OC3=CC(=CC(=C3)C#N)F)(F)F)O
• IUPAC Name: 3-[[(1S)-2,2-difluoro-1-hydroxy-7-methylsulfonyl-1,3-dihydroinden-4-yl]oxy]-5-fluorobenzonitrile
• InChIKey: ONBSHRSJOPSEGS-INIZCTEOSA-N
• INCHI: 1S/C17H12F3NO4S/c1-26(23,24)14-3-2-13(12-7-17(19,20)16(22)15(12)14)25-11-5-9(8-21)4-10(18)6-11/h2-6,16,22H,7H2,1H3/t16-/m0/s1
• Isomères SMILES: CS(=O)(=O)C1=C2[C@@H](C(CC2=C(C=C1)OC3=CC(=CC(=C3)C#N)F)(F)F)O
• PubChem CID: 91754484
• Poids moléculaire: 383.34

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diarylethers
• Alternative Parents: Indanes Phenoxy compounds Phenol ethers Benzonitriles Fluorobenzenes Aryl fluorides Sulfones Secondary alcohols Fluorohydrins Nitriles Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Diaryl ether - Indane - Phenoxy compound - Benzonitrile - Phenol ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Sulfone - Fluorohydrin - Secondary alcohol - Halohydrin - Nitrile - Carbonitrile - Organonitrogen compound - Organosulfur compound - Organohalogen compound - Alkyl fluoride - Alcohol - Hydrocarbon derivative - Organic oxide - Cyanide - Organic nitrogen compound - Alkyl halide - Organofluoride - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl 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

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: DMSO
• Sensibilité: air sensitive
• Poids moléculaire: 383.300 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 383.044 Da
• Monoisotopic Mass: 383.044 Da
• Topological Polar Surface Area: 95.800 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 686.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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 should this product be stored?

Store at ?20 °C, protected from light, 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 1672665-49-4, the molecular formula is C17H12F3NO4S, and the molecular weight is 383.34 g/mol. InChIKey ONBSHRSJOPSEGS-INIZCTEOSA-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.