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Home Other Building Blocks 1057394-06-5
1057394-06-5,MFCD28133371
Catalog No.:AA01DZEE

1057394-06-5 | AL8697

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
≥98%(HPLC)
in stock  
$675.00   $473.00
- +
10mg
≥98%(HPLC)
in stock  
$1,170.00   $819.00
- +
25mg
≥98%(HPLC)
in stock  
$2,561.00   $1,793.00
- +
50mg
≥98%(HPLC)
in stock  
$4,563.00   $3,194.00
- +
100mg
≥98%(HPLC)
in stock  
$8,166.00   $5,717.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01DZEE
Chemical Name:
AL8697
CAS Number:
1057394-06-5
Molecular Formula:
C21H21F3N4O
Molecular Weight:
402.4128
MDL Number:
MFCD28133371
SMILES:
O=C(c1cc(F)c(c(c1)c1c(F)cn2c(c1F)nnc2C(C)(C)C)C)NC1CC1
Properties
Computed Properties
 
Complexity:
626  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
5  

Literature

Title: Novel triazolopyridylbenzamides as potent and selective p38α inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20120515

Title: Balagué C, et al. Profiling of dihydroorotate dehydrogenase, p38 and JAK inhibitors in the rat adjuvant-induced arthritis model: a translational study. Br J Pharmacol. 2012 Jun;166(4):1320-32.

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SDS
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Tags:1057394-06-5 Molecular Formula|1057394-06-5 MDL|1057394-06-5 SMILES|1057394-06-5 AL8697