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1374744-69-0

1374744-69-0 Structure

1374744-69-0 Structure
IdentificationBack Directory
[Name]

N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide hydrochloride hydrate (1:2:1)
[CAS]

1374744-69-0
[Synonyms]

CL121
TG101348(2ClH.H2O)
Fedratinib hydrochloride hydrate
TG-101348 dihydrochloride hydrate
N-(tert-Butyl)-3-((5-methyl-2-((4-(2-(pyrrolidin-1-yl)ethoxy)phenyl)amino)pyrimidin-4-yl)amino)benzenesulfonamide dihydrochloride hydrate
N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide hydrochloride hydrate
N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide hydrochloride hydrate (1:2:1)
[Molecular Formula]

C27H40Cl2N6O4S
[MDL Number]

MFCD28137677
[MOL File]

1374744-69-0.mol
[Molecular Weight]

615.615
Chemical PropertiesBack Directory
[solubility ]

DMSO:250.0(Max Conc. mg/mL);409.09(Max Conc. mM)
[form ]

Solid
[color ]

White to yellow
[InChIKey]

QAFZLTVOFJHYDF-UHFFFAOYSA-N
[SMILES]

C1(S(NC(C)(C)C)(=O)=O)=CC=CC(NC2C(C)=CN=C(NC3=CC=C(OCCN4CCCC4)C=C3)N=2)=C1.[H]O[H].[H]Cl.[H]Cl
Hazard InformationBack Directory
[Uses]

A potent, highly selective and ATP-competitive JAK2 inhibitor with an IC50 of 3 nM for JAK2 and JAK2V617F.
[in vivo]

Fedratinib (TG101348; 60-120 mg/kg; oral gavage; twice daily; for 42 days; C57Bl/6 mice) trewatment shows a dose-dependent reduction in polycythemia and a marked dose-dependent reduction in splenomegaly of treated animals[1].

Animal Model:C57Bl/6 mice induced by the JAK2V617F mutation[1]
Dosage:60 mg/kg, 120 mg/kg
Administration:Oral gavage; twice daily; for 42 days
Result:Showed a statistically significant reduction in hematocrit and leukocyte count, a dose-dependent reduction/elimination of extramedullary hematopoiesis.
[IC 50]

JAK2: 3 nM (IC50); JAK2(V617F): 3 nM (IC50); Flt3: 15 nM (IC50); Ret: 48 nM (IC50)
Spectrum DetailBack Directory
[Spectrum Detail]

N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide hydrochloride hydrate (1:2:1)(1374744-69-0)1HNMR
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