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902135-91-5,MFCD13184820
Catalog No.:AA00GRRY

902135-91-5 | 4-(2,6-Dichlorobenzamido)-n-(piperidin-4-yl)-1h-pyrazole-3-carboxamide hydrochloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$46.00   $32.00
- +
5mg
98%
in stock  
$102.00   $71.00
- +
10mg
98%
in stock  
$153.00   $107.00
- +
25mg
98%
in stock  
$267.00   $187.00
- +
50mg
98%
in stock  
$345.00   $242.00
- +
100mg
98%
in stock  
$543.00   $380.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GRRY
Chemical Name:
4-(2,6-Dichlorobenzamido)-n-(piperidin-4-yl)-1h-pyrazole-3-carboxamide hydrochloride
CAS Number:
902135-91-5
Molecular Formula:
C16H18Cl3N5O2
Molecular Weight:
418.7054
MDL Number:
MFCD13184820
SMILES:
O=C(c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl)NC1CCNCC1.Cl
Properties
Computed Properties
 
Complexity:
479  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
4  

Downstream Synthesis Route

[1]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2008/1101,2008,A2Locationinpatent:Page/Pagecolumn360-361

[2]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2007/129062,2007,A1Locationinpatent:Page/Pagecolumn196-197

[3]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US2010/21420,2010,A1

[4]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2008/9954,2008,A1Locationinpatent:Page/Pagecolumn102-103

[1]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2006/77414,2006,A1Locationinpatent:Page/Pagecolumn157-158;175

AT7519 
  51517-01-2   
C19H23Cl2N5O5S 

[1]Patent:WO2006/77414,2006,A1.Locationinpatent:Page/Pagecolumn183

[1]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2006/77414,2006,A1Locationinpatent:Page/Pagecolumn169-170

[1]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2006/77414,2006,A1Locationinpatent:Page/Pagecolumn167-168

Literature

Title: Identification of N-(4-piperidinyl)-4-(2,6-dichlorobenzoylamino)-1H-pyrazole-3-carboxamide (AT7519), a novel cyclin dependent kinase inhibitor using fragment-based X-ray crystallography and structure based drug design.

Journal: Journal of medicinal chemistry 20080828

Title: Santo L, et al. AT7519, A novel small molecule multi-cyclin-dependent kinase inhibitor, induces apoptosis in multiple myeloma via GSK-3beta activation and RNA polymerase II inhibition. Oncogene. 2010 Apr 22;29(16):2325-36.

Title: Squires MS, et al. Biological characterization of AT7519, a small-molecule inhibitor of cyclin-dependent kinases, in human tumor cell lines. Biological characterization of AT7519, a small-molecule inhibitor of cyclin-dependent kinases, in human tumor cell lines.

Title: Squires MS, et al. AT7519, a cyclin-dependent kinase inhibitor, exerts its effects by transcriptional inhibition in leukemia cell lines and patient samples. Mol Cancer Ther. 2010 Apr;9(4):920-8.

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SDS
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Tags:902135-91-5 Molecular Formula|902135-91-5 MDL|902135-91-5 SMILES|902135-91-5 4-(2,6-Dichlorobenzamido)-n-(piperidin-4-yl)-1h-pyrazole-3-carboxamide hydrochloride