Home Quinolines 1276121-88-0
1276121-88-0,MFCD21363374
Catalog No.:AA000X53

1276121-88-0 | 8H-[1,4]Diazepino[5',6':4,5]thieno[3,2-f]quinolin-8-one, 9,10,11,12-tetrahydro-10-methyl-3-(6-methyl-3-pyridinyl)-, (10R)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥95%
in stock  
$52.00   $36.00
- +
5mg
≥95%
in stock  
$205.00   $143.00
- +
50mg
99%
in stock  
$376.00   $263.00
- +
100mg
99%
in stock  
$592.00   $415.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000X53
Chemical Name:
8H-[1,4]Diazepino[5',6':4,5]thieno[3,2-f]quinolin-8-one, 9,10,11,12-tetrahydro-10-methyl-3-(6-methyl-3-pyridinyl)-, (10R)-
CAS Number:
1276121-88-0
Molecular Formula:
C21H18N4OS
Molecular Weight:
374.4588
MDL Number:
MFCD21363374
SMILES:
C[C@@H]1CNc2c(C(=O)N1)sc1c2c2ccc(nc2cc1)c1ccc(nc1)C
Properties
Properties
 
Form:
Solid  
MP:
>180°C (dec.)  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
574  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
4  

Literature

Title: Mitogen-activated protein kinase-activated protein kinase 2 (MAPKAP-K2) as an antiinflammatory target: discovery and in vivo activity of selective pyrazolo[1,5-a]pyrimidine inhibitors using a focused library and structure-based optimization approach.

Journal: Journal of medicinal chemistry 20120809

Title: A benzothiophene inhibitor of mitogen-activated protein kinase-activated protein kinase 2 inhibits tumor necrosis factor alpha production and has oral anti-inflammatory efficacy in acute and chronic models of inflammation.

Journal: The Journal of pharmacology and experimental therapeutics 20100601

Title: Benzothiophene inhibitors of MK2. Part 2: improvements in kinase selectivity and cell potency.

Journal: Bioorganic & medicinal chemistry letters 20090815

Title: Mourey RJ, et al. A benzothiophene inhibitor of mitogen-activated protein kinase-activated protein kinase 2 inhibits tumor necrosis factor alpha production and has oral anti-inflammatory efficacy in acute and chronic models of inflammation. J Pharmacol Exp Ther. 2010 Jun;333(3):797-807

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Tags:1276121-88-0 Molecular Formula|1276121-88-0 MDL|1276121-88-0 SMILES|1276121-88-0 8H-[1,4]Diazepino[5',6':4,5]thieno[3,2-f]quinolin-8-one, 9,10,11,12-tetrahydro-10-methyl-3-(6-methyl-3-pyridinyl)-, (10R)-