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Home Other Building Blocks 2095393-15-8
2095393-15-8,MFCD31692379
Catalog No.:AA01EO5M

2095393-15-8 | ARQ 531

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
98%
in stock  
$322.00   $225.00
- +
25mg
98%
in stock  
$1,029.00   $720.00
- +
100mg
98%
in stock  
$2,974.00   $2,082.00
- +
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Technical Information
Catalog Number:
AA01EO5M
Chemical Name:
ARQ 531
CAS Number:
2095393-15-8
Molecular Formula:
C25H23ClN4O4
Molecular Weight:
478.9275
MDL Number:
MFCD31692379
SMILES:
OC[C@@H]1CC[C@H](CO1)Nc1ncnc2c1c(c[nH]2)C(=O)c1ccc(cc1Cl)Oc1ccccc1
Properties
Computed Properties
 
Complexity:
681  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
7  
XLogP3:
4.3  

Literature

Title: S Eathiraj, et al. Targeting PCI-32765-Resistant BTK-C481S Mutation with ARQ 531, a Reversible Non-Covalent Inhibitor of BTK. Clinical Lymphoma Myeloma & Leukemia, 2016, 16: S47-S48.

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