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AE11431

1204669-58-8 | Epacadostat

Packsize Purity Availability Price Discounted Price    Quantity
1mg 95% in stock $14.00 $10.00 -   +
2mg 95% in stock $17.00 $12.00 -   +
5mg 95% in stock $21.00 $15.00 -   +
10mg 95% in stock $31.00 $22.00 -   +
50mg 95% in stock $92.00 $65.00 -   +
100mg 95% in stock $138.00 $97.00 -   +
250mg 95% in stock $203.00 $142.00 -   +
1g 95% in stock $511.00 $358.00 -   +
5g 95% in stock $1,536.00 $1,075.00 -   +

*All products are for research use only and not intended for human or animal use.

*All prices are in USD.

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Description
Catalog Number: AE11431
Chemical Name: Epacadostat
CAS Number: 1204669-58-8
Molecular Formula: C11H13BrFN7O4S
Molecular Weight: 438.2328
MDL Number: MFCD29075639
SMILES: O/N=C(/c1nonc1NCCNS(=O)(=O)N)Nc1ccc(c(c1)Br)F

 

Computed Properties
Complexity: 563  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 25  
Hydrogen Bond Acceptor Count: 11  
Hydrogen Bond Donor Count: 5  
Rotatable Bond Count: 8  
XLogP3: 0.8  

 

 

Upstream Synthesis Route 
  • The compound [C(Z)]-4-[[2-[(Aminosulfonyl)amino]ethyl]amino]-N-(3-bromo-4-fluorophenyl)-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide is commonly utilized in chemical synthesis as a versatile building block. It serves as a key intermediate in the preparation of various pharmaceuticals, agrochemicals, and specialty chemicals. With its unique structural features, this compound plays a crucial role in the creation of complex molecules through organic synthesis strategies such as amide coupling reactions, peptide bond formation, and heterocycle synthesis. Its reactive functionality allows for selective transformation and derivatization, making it a valuable tool for synthetic chemists seeking to access diverse chemical structures efficiently and reliably.
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