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Home  > (R)-3-(4-(7H-Pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-3-cyclopentylpropanenitrile (Synonyms:Ruxolitinib)

AB46273

941678-49-5 | (R)-3-(4-(7H-Pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-3-cyclopentylpropanenitrile (Synonyms:Ruxolitinib)

Packsize Purity Availability Price Discounted Price    Quantity
1mg 98% in stock $10.00 $7.00 -   +
5mg 98% in stock $23.00 $17.00 -   +
10mg 98% in stock $34.00 $24.00 -   +
100mg 98% in stock $50.00 $35.00 -   +
250mg 98% in stock $101.00 $71.00 -   +
1g 98% in stock $298.00 $209.00 -   +
5g 95% in stock $1,179.00 $825.00 -   +
10g 95% in stock $1,879.00 $1,316.00 -   +

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*All prices are in USD.

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Description
Catalog Number: AB46273
Chemical Name: (R)-3-(4-(7H-Pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-3-cyclopentylpropanenitrile (Synonyms:Ruxolitinib)
CAS Number: 941678-49-5
Molecular Formula: C17H18N6
Molecular Weight: 306.3650
MDL Number: MFCD12031592
SMILES: N#CC[C@@H](n1ncc(c1)c1[nH]cnc2c1ccn2)C1CCCC1

 

Computed Properties
Complexity: 453  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Heavy Atom Count: 23  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 4  
XLogP3: 2.1  

 

 

Upstream Synthesis Route 
  • (βR)-β-Cyclopentyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazole-1-propanenitrile is a highly versatile compound commonly used in chemical synthesis as a key building block for the creation of various pharmaceuticals, agrochemicals, and materials. Its unique molecular structure allows it to participate in a wide range of reactions, making it an essential tool for organic chemists.In chemical synthesis, this compound serves as a valuable intermediate for the preparation of diverse bioactive molecules due to its functional groups and stereochemistry. Its cyclopentyl and pyrazole moieties provide opportunities for further derivatization, enabling the introduction of specific substituents to tailor the properties of the final products. Additionally, the pyrrolopyrimidine core confers biological activity, making this compound particularly useful in the design and development of new drugs.Overall, (βR)-β-Cyclopentyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazole-1-propanenitrile plays a crucial role in the strategic construction of complex molecules, showcasing its importance in modern organic synthesis and drug discovery efforts.
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