ChemicalBook--->CAS DataBase List--->2097252-39-4

2097252-39-4

2097252-39-4 Structure

2097252-39-4 Structure
IdentificationBack Directory
[Name]

CHK1-IN-3
[CAS]

2097252-39-4
[Synonyms]

CHK1-IN-3
CHK1IN3,CHK1 IN 3,CHK-1-IN-3
2-Pyridinecarbonitrile, 5-[[4-(methylamino)-5-(1-methyl-1H-pyrazol-4-yl)-2-pyrimidinyl]amino]-3-[(3R)-3-piperidinyloxy]-
[Molecular Formula]

C20H23N9O
[MDL Number]

MFCD32067980
[MOL File]

2097252-39-4.mol
[Molecular Weight]

405.46
Chemical PropertiesBack Directory
[Boiling point ]

737.0±70.0 °C(Predicted)
[density ]

1.41±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

8.58±0.10(Predicted)
[color ]

Off-white to light yellow
Hazard InformationBack Directory
[Uses]

CHK1-IN-3 is a Checkpoint Kinase 1 (CHK1) inhibitor with an IC50 of 0.4 nM[1].
[in vivo]

CHK1-IN-3 significantly suppresses the tumor growth in Z-138 cell inoculated xenograft model as a single agent with body weight unaffected[1].

[IC 50]

Chk1: 0.4 nM (IC50)
[References]

[1] Tong L, et al. Discovery of (R)-5-((5-(1-methyl-1H-pyrazol-4-yl)-4-(methylamino)pyrimidin-2-yl)amino)-3-(piperidin-3-yloxy)picolinonitrile, a novel CHK1 inhibitor for hematologic malignancies. Eur J Med Chem. 2019 Jul 1;173:44-62. DOI:10.1016/j.ejmech.2019.03.062
Spectrum DetailBack Directory
[Spectrum Detail]

CHK1-IN-3(2097252-39-4)1HNMR
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