Home Amines 717907-75-0
717907-75-0,MFCD16038299
Catalog No.:AA00FADA

717907-75-0 | N-[3-[[[2-[(2,3-Dihydro-2-oxo-1h-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]-2-pyridinyl]-n-methyl-methanesulfonamide

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1mg
98+%
in stock  
$62.00   $43.00
- +
10mg
98+%
in stock  
$234.00   $164.00
- +
50mg
≥98%
in stock  
$932.00   $653.00
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100mg
≥98%
in stock  
$1,634.00   $1,144.00
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1000mg
98% by HPLC
in stock  
$15,433.00   $10,803.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00FADA
Chemical Name:
N-[3-[[[2-[(2,3-Dihydro-2-oxo-1h-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]-2-pyridinyl]-n-methyl-methanesulfonamide
CAS Number:
717907-75-0
Molecular Formula:
C21H20F3N7O3S
Molecular Weight:
507.4888
MDL Number:
MFCD16038299
SMILES:
O=C1Nc2c(C1)cc(cc2)Nc1ncc(c(n1)NCc1cccnc1N(S(=O)(=O)C)C)C(F)(F)F
Properties
Computed Properties
 
Complexity:
856  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
7  
XLogP3:
2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:VERASTEMINC;PFIZERINC-US2011/33441,2011,A1Locationinpatent:Page/Pagecolumn9

[1]CurrentPatentAssignee:VERASTEMINC;PFIZERINC-US2011/33441,2011,A1Locationinpatent:Page/Pagecolumn8

[1]CurrentPatentAssignee:VERASTEMINC;PFIZERINC-US2011/33441,2011,A1Locationinpatent:Page/Pagecolumn10

[1]CurrentPatentAssignee:VERASTEMINC;PFIZERINC-US2011/33441,2011,A1Locationinpatent:Page/Pagecolumn10

Literature

Title: Identification of potent Yes1 kinase inhibitors using a library screening approach.

Journal: Bioorganic & medicinal chemistry letters 20130801

Title: The role of focal adhesion kinase catalytic activity on the proliferation and migration of squamous cell carcinoma cells.

Journal: International journal of cancer 20120715

Title: Mechanism-based inactivation (MBI) of cytochrome P450 enzymes: structure-activity relationships and discovery strategies to mitigate drug-drug interaction risks.

Journal: Journal of medicinal chemistry 20120614

Title: Inhibition of focal adhesion kinase prevents experimental lung fibrosis and myofibroblast formation.

Journal: Arthritis and rheumatism 20120501

Title: Inhibition of focal adhesion kinase by PF-562,271 inhibits the growth and metastasis of pancreatic cancer concomitant with altering the tumor microenvironment.

Journal: Molecular cancer therapeutics 20111101

Title: Clinical importance and potential use of small molecule inhibitors of focal adhesion kinase.

Journal: Anti-cancer agents in medicinal chemistry 20110901

Title: Transforming growth factor-β-induced epithelial-mesenchymal transition facilitates epidermal growth factor-dependent breast cancer progression.

Journal: Oncogene 20101209

Title: Bioluminescent imaging study: FAK inhibitor, PF-562,271, preclinical study in PC3M-luc-C6 local implant and metastasis xenograft models.

Journal: Cancer biology & therapy 20100701

Title: Emerging targets in osteoporosis disease modification.

Journal: Journal of medicinal chemistry 20100610

Title: Sunitinib and PF-562,271 (FAK/Pyk2 inhibitor) effectively block growth and recovery of human hepatocellular carcinoma in a rat xenograft model.

Journal: Cancer biology & therapy 20090501

Title: Therapeutic targeting of the focal adhesion complex prevents oncogenic TGF-beta signaling and metastasis.

Journal: Breast cancer research : BCR 20090101

Title: Dual focal adhesion kinase/Pyk2 inhibitor has positive effects on bone tumors: implications for bone metastases.

Journal: Cancer 20080515

Title: Antitumor activity and pharmacology of a selective focal adhesion kinase inhibitor, PF-562,271.

Journal: Cancer research 20080315

Title: Roberts WG, et al. Antitumor activity and pharmacology of a selective focal adhesion kinase inhibitor, PF-562,271. Cancer Res, 2008, 68(6), 1935-1944.

Title: Crompton BD, et al. High-throughput tyrosine kinase activity profiling identifies FAK as a candidate therapeutic target in Ewing sarcoma. Cancer Res. 2013 May 1;73(9):2873-83.

Title: Bagi CM, et al. Dual focal adhesion kinase/Pyk2 inhibitor has positive effects on bone tumors: implications for bone metastases. Cancer. 2008 May 15;112(10):2313-21.

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SDS
Tags:717907-75-0 Molecular Formula|717907-75-0 MDL|717907-75-0 SMILES|717907-75-0 N-[3-[[[2-[(2,3-Dihydro-2-oxo-1h-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]-2-pyridinyl]-n-methyl-methanesulfonamide