Org 48762-0 - ≥98% , CAS No.755753-89-0

CAS: 755753-89-0 Cat. No.: O286758 Molecular Weight: 398.41

GRADE & PURITY ≥98%

Synonyms

Org 48762-0 | SCHEMBL1386962 | 4,6-Bis(4-fluorophenyl)-2-methyl-5-(pyridin-4-yl)-2H-pyrazolo[3,4-b]pyridine | HY-114221 | 4,6-bis(4-fluorophenyl)-2-methyl-5-pyridin-4-ylpyrazolo[3,4-b]pyridine | 4,6-Bis(4-fluorophenyl)-2-methyl-5-(4-pyridyl)-2H-pyrazolo(3

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Overview

Org 48762-0 is a selective p38α and β kinase inhibitor (EC50 = 0.1 μM for p38α). Selective for p38α/β over a panel of 48 other human kinases. Inhibits LPS-induced TNFα release from PBMCs. Also inhibits cytokine release in an LPS-induced endotoxemia model in mice. Orally bioavailable.

Specifications

Synonyms

Org 48762-0 | SCHEMBL1386962 | 4, 6-Bis(4-fluorophenyl)-2-methyl-5-(pyridin-4-yl)-2H-pyrazolo[3, 4-b]pyridine | HY-114221 | 4, 6-bis(4-fluorophenyl)-2-methyl-5-pyridin-4-ylpyrazolo[3, 4-b]pyridine | 4, 6-Bis(4-fluorophenyl)-2-methyl-5-(4-pyridyl)-2H-pyrazolo(3

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Selective p38αandβkinase inhibitor (EC50= 0.1μM for p38α). Selective for p38α/βover a panel of 48 other human kinases. Inhibits LPS-induced TNFαrelease from PBMCs. Also inhibits cytokine release in an LPS-induced endotoxemia model in mice. Orally bioavail

Storage

Store at 2-8°C, Protected from light

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

INHIBITOR

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CN1C=C2C(=C(C(=NC2=N1)C3=CC=C(C=C3)F)C4=CC=NC=C4)C5=CC=C(C=C5)F
• IUPAC Name: 4,6-bis(4-fluorophenyl)-2-methyl-5-pyridin-4-ylpyrazolo[3,4-b]pyridine
• InChIKey: VMAKTIDYMSNPOV-UHFFFAOYSA-N
• INCHI: 1S/C24H16F2N4/c1-30-14-20-21(15-2-6-18(25)7-3-15)22(16-10-12-27-13-11-16)23(28-24(20)29-30)17-4-8-19(26)9-5-17/h2-14H,1H3
• Isomeric SMILES: CN1C=C2C(=C(C(=NC2=N1)C3=CC=C(C=C3)F)C4=CC=NC=C4)C5=CC=C(C=C5)F
• Molecular Weight: 398.41
• Reaxy-Rn: 12014115
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=12014115&ln=

Chemical and Physical Properties

• Solubility: Solvent:DMSO, Max Conc. mg/mL: 39.84, Max Conc. mM: 100; Solvent:1eq. HCl, Max Conc. mg/mL: 19.92, Max Conc. mM: 50
• Sensitivity: Light sensitive
• Molecular Weight: 398.400 g/mol
• XLogP3: 4.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 398.134 Da
• Monoisotopic Mass: 398.134 Da
• Topological Polar Surface Area: 43.600 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 555.000
• 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