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Home Amines 630124-46-8
630124-46-8,MFCD08353320
Catalog No.:AA003AG6

630124-46-8 | 1-(4-((4-Ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-3-(4-((6-(methylamino)pyrimidin-4-yl)oxy)phenyl)urea

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$48.00   $33.00
- +
5mg
98%
in stock  
$131.00   $92.00
- +
10mg
98%
in stock  
$237.00   $166.00
- +
25mg
98%
in stock  
$499.00   $349.00
- +
50mg
98%
in stock  
$852.00   $597.00
- +
100mg
98%
in stock  
$1,559.00   $1,092.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003AG6
Chemical Name:
1-(4-((4-Ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-3-(4-((6-(methylamino)pyrimidin-4-yl)oxy)phenyl)urea
CAS Number:
630124-46-8
Molecular Formula:
C26H30F3N7O2
Molecular Weight:
529.5573
MDL Number:
MFCD08353320
SMILES:
CCN1CCN(CC1)Cc1ccc(cc1C(F)(F)F)NC(=O)Nc1ccc(cc1)Oc1ncnc(c1)NC
Properties
Computed Properties
 
Complexity:
730  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
8  
XLogP3:
3.8  

Downstream Synthesis Route
654-70-6   
AST-487 
 
C23H22N8O3 

[1]OrganicProcessResearchandDevelopment,2008,vol.12,p.1146-1155

654-70-6   
AST-487 

[1]OrganicProcessResearchandDevelopment,2008,vol.12,p.1146-1155

[2]OrganicProcessResearchandDevelopment,2008,vol.12,p.1146-1155

876322-73-5    630124-46-8   
CASUnavailable 

[1]Shieh,Wen-Chung;Mckenna,Joe;Sclafani,JosephA.;Xue,Song;Girgis,Michael;Vivelo,James;Radetich,Branko;Prasad,Kapa[OrganicProcessResearchandDevelopment,2008,vol.12,#6,p.1146-1155]

[1]Shieh,Wen-Chung;Mckenna,Joe;Sclafani,JosephA.;Xue,Song;Girgis,Michael;Vivelo,James;Radetich,Branko;Prasad,Kapa[OrganicProcessResearchandDevelopment,2008,vol.12,#6,p.1146-1155]

[2]Shieh,Wen-Chung;Mckenna,Joe;Sclafani,JosephA.;Xue,Song;Girgis,Michael;Vivelo,James;Radetich,Branko;Prasad,Kapa[OrganicProcessResearchandDevelopment,2008,vol.12,#6,p.1146-1155]

CASUnavailable 
  630124-46-8   
CASUnavailable 

[1]Shieh,Wen-Chung;Mckenna,Joe;Sclafani,JosephA.;Xue,Song;Girgis,Michael;Vivelo,James;Radetich,Branko;Prasad,Kapa[OrganicProcessResearchandDevelopment,2008,vol.12,#6,p.1146-1155]

Literature

Title: Comprehensive analysis of kinase inhibitor selectivity.

Journal: Nature biotechnology 20111030

Title: Discovery, synthesis, and investigation of the antitumor activity of novel piperazinylpyrimidine derivatives.

Journal: European journal of medicinal chemistry 20110601

Title: Activation state-dependent binding of small molecule kinase inhibitors: structural insights from biochemistry.

Journal: Chemistry & biology 20101124

Title: Antileukemic effects of the novel, mutant FLT3 inhibitor NVP-AST487: effects on PKC412-sensitive and -resistant FLT3-expressing cells.

Journal: Blood 20081215

Title: A quantitative analysis of kinase inhibitor selectivity.

Journal: Nature biotechnology 20080101

Title: The RET kinase inhibitor NVP-AST487 blocks growth and calcitonin gene expression through distinct mechanisms in medullary thyroid cancer cells.

Journal: Cancer research 20070715

Title: Akeno-Stuart N, et al. The RET Kinase Inhibitor NVP-AST487 Blocks Growth and Calcitonin Gene Expression through Distinct Mechanisms in Medullary Thyroid Cancer Cells. Cancer Res. 2007 Jul 15;67(14):6956-64.

Title: Weisberg E, et al. Antileukemic effects of the novel, mutant FLT3 inhibitor NVP-AST487: effects on PKC412-sensitive and -resistant FLT3-expressing cells. Blood. 2008 Dec 15;112(13):5161-70.

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SDS
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Tags:630124-46-8 Molecular Formula|630124-46-8 MDL|630124-46-8 SMILES|630124-46-8 1-(4-((4-Ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-3-(4-((6-(methylamino)pyrimidin-4-yl)oxy)phenyl)urea