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54346-19-9,MFCD08275129
Catalog No.:AA00D7X6

54346-19-9 | 4-Chloro-2-(methylthio)pyrazolo[1,5-a][1,3,5]triazine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$19.00   $14.00
- +
250mg
97%
in stock  
$38.00   $27.00
- +
1g
97%
in stock  
$115.00   $81.00
- +
5g
97%
in stock  
$573.00   $401.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00D7X6
Chemical Name:
4-Chloro-2-(methylthio)pyrazolo[1,5-a][1,3,5]triazine
CAS Number:
54346-19-9
Molecular Formula:
C6H5ClN4S
Molecular Weight:
200.6487
MDL Number:
MFCD08275129
SMILES:
CSc1nc(Cl)n2c(n1)ccn2
Properties
Properties
 
BP:
311.5°C at 760 mmHg  
Form:
Solid  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
170  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistry,2011,vol.19,#20,p.5955-5966

[2]Patent:US2007/78136,2007,A1,.Locationinpatent:Page/Pagecolumn50

[3]Patent:WO2011/31979,2011,A1,.Locationinpatent:Page/Pagecolumn147

[4]Patent:US9303033,2016,B2,.Locationinpatent:Page/Pagecolumn285;286

[5]Patent:JP5802676,2015,B2,.Locationinpatent:Paragraph0552

[6]Patent:WO2011/79231,2011,A1,.Locationinpatent:Page/Pagecolumn105

[7]Patent:WO2012/17030,2012,A1,.Locationinpatent:Page/Pagecolumn13-14

[8]Patent:US2013/109694,2013,A1,.Locationinpatent:Paragraph0077

[9]Patent:WO2015/193169,,A1,.Locationinpatent:Page/Pagecolumn54;55

[9]Patent:,2015,,.Locationinpatent:Page/Pagecolumn54;55

[11]Patent:WO2016/142855,2016,A2,.Locationinpatent:Page/Pagecolumn41

[1]Patent:WO2009/126514,2009,A1,.Locationinpatent:Page/Pagecolumn36

[1]BioorganicandMedicinalChemistry,2011,vol.19,#20,p.5955-5966

[2]Patent:WO2012/17030,2012,A1,

[3]Patent:WO2011/79231,2011,A1,

[4]Patent:US2013/109694,2013,A1,

[5]Patent:WO2015/193169,,A1,

[5]Patent:,2015,,

[1]BioorganicandMedicinalChemistry,2011,vol.19,#20,p.5955-5966

[2]Patent:WO2011/79231,2011,A1,

[3]Patent:WO2015/193169,,A1,

[3]Patent:,2015,,

[1]Patent:WO2012/17030,2012,A1,

[2]Patent:US2013/109694,2013,A1,

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1982,vol.25,p.243-249

[1]JournalofMedicinalChemistry,1982,vol.25,p.243-249

[1]JournalofMedicinalChemistry,1982,vol.25,p.243-249

Literature
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SDS
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Tags:54346-19-9 Molecular Formula|54346-19-9 MDL|54346-19-9 SMILES|54346-19-9 4-Chloro-2-(methylthio)pyrazolo[1,5-a][1,3,5]triazine