Home Amines 61667-16-1
61667-16-1,MFCD00679879
Catalog No.:AA00EE3D

61667-16-1 | N-Benzyl-6-chloropyrimidin-4-amine

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100mg
95%
in stock  
$184.00   $129.00
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250mg
95%
in stock  
$255.00   $179.00
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1g
95%
in stock  
$460.00   $322.00
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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:
AA00EE3D
Chemical Name:
N-Benzyl-6-chloropyrimidin-4-amine
CAS Number:
61667-16-1
Molecular Formula:
C11H10ClN3
Molecular Weight:
219.6702
MDL Number:
MFCD00679879
SMILES:
Clc1ncnc(c1)NCc1ccccc1
Properties
Properties
 
BP:
381 °C at 760 mmHg  
Form:
Solid  
MP:
116-117℃  

Computed Properties
 
Complexity:
183  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3  

Downstream Synthesis Route

[1]Whitehead;Traverso[JournaloftheAmericanChemicalSociety,1958,vol.80,p.2182,2184]

[2]Whitehead;Traverso[JournaloftheAmericanChemicalSociety,1958,vol.80,p.2182,2184]

110-91-8    61667-16-1   
N-benzyl-6-morpholin-4-ylpyrimidin-4-amine 

[1]Luo,Guanglin;Chen,Ling;Poindexter,GrahamS[TetrahedronLetters,2002,vol.43,#33,p.5739-5742]

[2]vanderWesthuyzen,ChristiaanW.;Rousseau,AmandaL.;Parkinson,ChristopherJ.[Tetrahedron,2007,vol.63,#25,p.5394-5405]

[1]Dolbois,Aymeric;Bedi,RajivK.;Bochenkova,Elena;Müller,Anna;Moroz-Omori,ElenaV.;Huang,Danzhi;Caflisch,Amedeo[JournalofMedicinalChemistry,2021,vol.64,#17,p.12738-12760]

[2]Luo,Guanglin;Chen,Ling;Poindexter,GrahamS[TetrahedronLetters,2002,vol.43,#33,p.5739-5742]

[3]vanderWesthuyzen,ChristiaanW.;Rousseau,AmandaL.;Parkinson,ChristopherJ.[Tetrahedron,2007,vol.63,#25,p.5394-5405]

[4]CurrentPatentAssignee:VERTEXPHARMACEUTICALS(OLD)-WO2005/95400,2005,A1Locationinpatent:Page/Pagecolumn326;329

[5]Farmer,LucJ.;Ledeboer,MarkW.;Hoock,Thomas;Arnost,MichaelJ.;Bethiel,RandyS.;Bennani,YoussefL.;Black,JamesJ.;Brummel,ChristopherL.;Chakilam,Ananthsrinivas;Dorsch,WarrenA.;Fan,Bin;Cochran,JohnE.;Halas,Summer;Harrington,EdmundM.;Hogan,JamesK.;Howe,David;Huang,Hui;Jacobs,DylanH.;Laitinen,LeenaM.;Liao,Shengkai;Mahajan,Sudipta;Marone,Valerie;Martinez-Botella,Gabriel;McCarthy,Pamela;Messersmith,David;Namchuk,Mark;Oh,Luke;Penney,MarinaS.;Pierce,AlbertC.;Raybuck,ScottA.;Rugg,Arthur;Salituro,FrancescoG.;Saxena,Kumkum;Shannon,Dean;Shlyakter,Dina;Swenson,Lora;Tian,Shi-Kai;Town,Christopher;Wang,Jian;Wang,Tiansheng;Wannamaker,M.Woods;Winquist,RaymondJ.;Zuccola,HarmonJ.[JournalofMedicinalChemistry,2015,vol.58,#18,p.7195-7216]

[6]Locationinpatent:experimentalpartSander,Kerstin;Kottke,Tim;Tanrikulu,Yusuf;Proschak,Ewgenij;Weizel,Lilia;Schneider,ErichH.;Seifert,Roland;Schneider,Gisbert;Stark,Holger[BioorganicandMedicinalChemistry,2009,vol.17,#20,p.7186-7196]

[7]CurrentPatentAssignee:EISAICOLTD-WO2015/57938,2015,A1Locationinpatent:Page/Pagecolumn73

[8]Locationinpatent:bodytextMasood,M.Abid;Selby,MatthewD.;Bell,AndrewS.;Mansfield,AndrewC.;Gardner,Mark;Smith,GrahamF.;Smith,CharlotteLane;Kenyon-Edwards,Helen;Osborne,Rachel;Jones,RhysM.;Liu,WaiL.;Brown,ChristopherD.;Clarke,Nicholas;Perrucio,Francesca;Mowbray,CharlesE.[BioorganicandMedicinalChemistryLetters,2011,vol.21,#21,p.6591-6595]

[9]Locationinpatent:schemeortableJakubkiene,Virginija;Čikotiene,Inga[Tetrahedron,2012,vol.68,#10,p.2294-2298]

[10]Cikotiene,Inga;Jonusis,Mantas;Jakubkiene,Virginija[BeilsteinJournalofOrganicChemistry,2013,vol.9,p.1819-1825]

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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Tags:61667-16-1 Molecular Formula|61667-16-1 MDL|61667-16-1 SMILES|61667-16-1 N-Benzyl-6-chloropyrimidin-4-amine