PF-07220060 (CDK4/6-in-6) is a potent inhibitor of CDK4/CDK6. For CDK4/Cyclin D1 and CDK4/Cyclin D1, Ki values of 0.6 nM and 13.9 nM were >CDK6/Cyclin D3, respectively.

 

Brand: BCM

 

Target: CDK

 

Signaling Pathways: Cell Cycle/Checkpoint

 

In Vitro: Using phosphorylated Rb S795 ELISA assay in JEKO-1 cells, CDK4/6-IN-6 has IC50s of 38.5 nM for CDK4/Cyclin D1 and 144.9 nM for CDK6/Cyclin D3, respectively. 

 

Boiling Point: 687.4±65.0 °C(Predicted)

 

pKa: 13.43±0.29(Predicted)

 

Solubility: Soluble in DMSO; soluble in Ethanol. Insoluble in Water.

 

Isomeric SMILES: CC(C)N1C2=C(C(=CC(=C2)C3=NC(=NC=C3Cl)N[C@@H]4CCOC[C@H]4O)F)N=C1C(C)(C)O  

 

InChIKey: QYJLBHRAPDJOSO-NVXWUHKLSA-N  

 

InChI: InChI=1S/C22H27ClFN5O3/c1-11(2)29-16-8-12(7-14(24)19(16)27-20(29)22(3,4)31)18-13(23)9-25-21(28-18)26-15-5-6-32-10-17(15)30/h7-9,11,15,17,30-31H,5-6,10H2,1-4H3,(H,25,26,28)/t15-,17-/m1/s1

 

Attribute
[Chem Name]	(3S,4R)-4-[[5-chloro-4-[7-fluoro-2-(2-hydroxypropan-2-yl)-3-propan-2-ylbenzimidazol-5-yl]pyrimidin-2-yl]amino]oxan-3-ol
[Synonym]	PF-07220060; CDK4/6-IN-6
[CAS No.]	2380321-51-5
[MDL No.]	MFCD34567737
[Formula]	C22H27ClFN5O3
[Molecular]	463.94
[Form]	Solid Powder
[Storage]	Keep in dark place. Sealed in dry, 2-8°C

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