1575596-29-0,MFCD31631583
Catalog No.:AA01EO5V

1575596-29-0 | PRN1008

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
95%
in stock  
$598.00   $419.00
- +
10mg
95%
in stock  
$912.00   $639.00
- +
25mg
95%
in stock  
$1,797.00   $1,258.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01EO5V
Chemical Name:
PRN1008
CAS Number:
1575596-29-0
Molecular Formula:
C36H40FN9O3
Molecular Weight:
665.7597
MDL Number:
MFCD31631583
SMILES:
N#C/C(=C\C(N1CCN(CC1)C1COC1)(C)C)/C(=O)N1CCC[C@H](C1)n1nc(c2c1ncnc2N)c1ccc(cc1F)Oc1ccccc1
Properties
Computed Properties
 
Complexity:
1230  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
49  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
8  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.4  

Literature

Title: Smith PF, et al. A phase I trial of PRN1008, a novel reversible covalent inhibitor of Bruton's tyrosine kinase, in healthy volunteers. Br J Clin Pharmacol. 2017 Nov;83(11):2367-2376.

Title: Hill RJ, Bradshaw JM, Bisconte A, Tam D, Owens TD, Brameld KA, Smith PF, Funk JO, Goldstein DM, Nunn PA. Preclinical Characterization of PRN1008, a Novel Reversible Covalent Inhibitor of BTK that Shows Efficacy in a RAT Model of Collagen-Induced Arthritis. Annals of the Rheumatic Diseases 2015; 74(Suppl 2): 216.

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SDS
Related Products of 1575596-29-0
Tags:1575596-29-0 Molecular Formula|1575596-29-0 MDL|1575596-29-0 SMILES|1575596-29-0 PRN1008
Catalog No.: AA01EO5V
1575596-29-0,MFCD31631583
1575596-29-0 | PRN1008
Pack Size: 5mg
Purity: 95%
in stock
$598.00 $419.00
Pack Size: 10mg
Purity: 95%
in stock
$912.00 $639.00
Pack Size: 25mg
Purity: 95%
in stock
$1,797.00 $1,258.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA01EO5V
Chemical Name: PRN1008
CAS Number: 1575596-29-0
Molecular Formula: C36H40FN9O3
Molecular Weight: 665.7597
MDL Number: MFCD31631583
SMILES: N#C/C(=C\C(N1CCN(CC1)C1COC1)(C)C)/C(=O)N1CCC[C@H](C1)n1nc(c2c1ncnc2N)c1ccc(cc1F)Oc1ccccc1
Properties
Complexity: 1230  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 49  
Hydrogen Bond Acceptor Count: 11  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 8  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.4  
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