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32889-45-5,MFCD10566402
Catalog No.:AA00CHWM

32889-45-5 | 4,6-Dichloro-N-cyclopropyl-1,3,5-triazin-2-amine

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00CHWM
Chemical Name:
4,6-Dichloro-N-cyclopropyl-1,3,5-triazin-2-amine
CAS Number:
32889-45-5
Molecular Formula:
C6H6Cl2N4
Molecular Weight:
205.0446
MDL Number:
MFCD10566402
SMILES:
Clc1nc(NC2CC2)nc(n1)Cl
Properties
Properties
 
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
154  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Modh,RahulP.;DeClercq,Erik;Pannecouque,Christophe;Chikhalia,KishorH.[JournalofEnzymeInhibitionandMedicinalChemistry,2014,vol.29,#1,p.100-108]

[2]Ballesteros,Berta;Barcelo,Damia;Sanchez-Baeza,Francisco;Camps,Francisco;Marco,Maria-Pilar[AnalyticalChemistry,1998,vol.70,#19,p.4004-4014]

[3]Locationinpatent:experimentalpartManohar,Sunny;Khan,ShabanaI.;Rawat,DiwanS.[ChemicalBiologyandDrugDesign,2011,vol.78,#1,p.124-136]

[4]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-US4225598,1980,A

[5]CurrentPatentAssignee:H.LUNDBECKA/S-US6340683,2002,B1Locationinpatent:Pagecolumn17

[6]CurrentPatentAssignee:SHANDONGEXCERISCHEMICAL-CN112851594,2021,ALocationinpatent:Paragraph0040-0044;0048-0052;0056-0060

32889-45-5    56-12-2   
4-(4-Chloro-6-cyclopropylamino-1,3,5triazin-2-ylamino)-butyricacid 

[1]Ballesteros,Berta;Barcelo,Damia;Sanchez-Baeza,Francisco;Camps,Francisco;Marco,Maria-Pilar[AnalyticalChemistry,1998,vol.70,#19,p.4004-4014]

32889-45-5   
4-(4-Cyclopropylamino-6-methylsulfanyl-1,3,5triazin-2-ylamino)-butyricacid 

[1]Ballesteros,Berta;Barcelo,Damia;Sanchez-Baeza,Francisco;Camps,Francisco;Marco,Maria-Pilar[AnalyticalChemistry,1998,vol.70,#19,p.4004-4014]

[1]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-US4225598,1980,A

[1]Locationinpatent:experimentalpartManohar,Sunny;Khan,ShabanaI.;Rawat,DiwanS.[ChemicalBiologyandDrugDesign,2011,vol.78,#1,p.124-136]

Literature
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SDS
Tags:32889-45-5 Molecular Formula|32889-45-5 MDL|32889-45-5 SMILES|32889-45-5 4,6-Dichloro-N-cyclopropyl-1,3,5-triazin-2-amine