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ChemicalBook--->CAS DataBase List--->2095719-90-5

2095719-90-5

2095719-90-5 Structure

2095719-90-5 Structure
IdentificationBack Directory
[Name]

ERK1/2 inhibitor 1
[CAS]

2095719-90-5
[Synonyms]

ERK1/2 INHIBITOR 1
2H-Isoindole-2-acetamide, 6-[5-chloro-2-[(tetrahydro-2H-pyran-4-yl)amino]-4-pyrimidinyl]-1,3-dihydro-N-[(1S)-2-hydroxy-1-(3-methylphenyl)ethyl]-α-methyl-1-oxo-, (αR)-
[Molecular Formula]

C29H32ClN5O4
[MDL Number]

MFCD31813665
[MOL File]

2095719-90-5.mol
[Molecular Weight]

550.06
Chemical PropertiesBack Directory
[density ]

1.344±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 250 mg/mL (454.50 mM; Need ultrasonic)
[form ]

Solid
[pka]

13.73±0.46(Predicted)
[color ]

Off-white to light yellow
Spectrum DetailBack Directory
[Spectrum Detail]

ERK1/2 inhibitor 1(2095719-90-5)1HNMR
Hazard InformationBack Directory
[Biological Activity]

ERK1/2 inhibitor 1 is a potent, orally bioavailable ERK1/2 inhibitor, showing 60% inhibition at 1 nM and an IC50 of 3.0 nM against ERK1 and ERK2, respectively[1]. ERK1/2 inhibitor 1 (Compound 27) shows excellent antiproliferative potency with IC50s of 4.9 and 7.5 nM in A375 and Colo205 cells, respectively[1].
[References]

[1]. Heightman TD, et al. Fragment-Based Discovery of a Potent, Orally Bioavailable Inhibitor That Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J Med Chem. 2018 Jun 14;61(11):4978-4992.
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