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Home Amines 55778-02-4
55778-02-4,MFCD18086914
Catalog No.:AA00DA8F

55778-02-4 | N-[(4-{[(Pyridin-2-yl)amino]methyl}phenyl)methyl]pyridin-2-amine

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1mg
≥95%
in stock  
$28.00   $19.00
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5mg
≥95%
in stock  
$112.00   $78.00
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10mg
in stock  
$192.00   $134.00
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25mg
98% by HPLC
in stock  
$419.00   $293.00
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50mg
in stock  
$433.00   $303.00
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100mg
in stock  
$611.00   $428.00
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500mg
in stock  
$1,429.00   $1,000.00
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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:
AA00DA8F
Chemical Name:
N-[(4-{[(Pyridin-2-yl)amino]methyl}phenyl)methyl]pyridin-2-amine
CAS Number:
55778-02-4
Molecular Formula:
C18H18N4
Molecular Weight:
290.3623
MDL Number:
MFCD18086914
SMILES:
c1ccc(nc1)NCc1ccc(cc1)CNc1ccccn1
Properties
Properties
 
Form:
Solid  
MP:
192-194℃ (methanol )  
Storage:
Light sensitive;Inert atmosphere;-20 ℃;  

Computed Properties
 
Complexity:
272  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
6  
XLogP3:
3.4  

Downstream Synthesis Route
1171-47-7   
WZ811 
 
mono(2,2'-(1,4-phenylenebis(methylene))bis(azanediyl)dipyridinium)di(4-(2-(4-carboxyphenyl)-1,1,1,3,3,3-hexafluoropropane-2-yl)benzoate) 

[1]Tripuramallu,BharatKumar[JournalofMolecularStructure,2014,vol.1071,#1,p.79-87]

Literature

Title: Dipyrimidine amines: a novel class of chemokine receptor type 4 antagonists with high specificity.

Journal: Journal of medicinal chemistry 20101223

Title: 2,2'-[p-Phenyl-enebis(methyl-idene-aza-ne-di-yl)]dipyridinium bis-(hydrogensulfate) dihydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20101201

Title: Syntheses and structures of copper(I) complexes based on Cu(n)X(n) (X = Br and I; n = 1, 2 and 4) units and bis(pyridyl) ligands with longer flexible spacer.

Journal: Dalton transactions (Cambridge, England : 2003) 20101114

Title: Discovery of small molecule CXCR4 antagonists.

Journal: Journal of medicinal chemistry 20071115

Title: WZ811, et al. Discovery of small molecule CXCR4 antagonists. J Med Chem. 2007 Nov 15;50(23):5655-64.

Title: Li SH, et al. Suppression of chronic lymphocytic leukemia progression by CXCR4 inhibitor WZ811. Am J Transl Res. 2016 Sep 15;8(9):3812-3821.

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SDS
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Tags:55778-02-4 Molecular Formula|55778-02-4 MDL|55778-02-4 SMILES|55778-02-4 N-[(4-{[(Pyridin-2-yl)amino]methyl}phenyl)methyl]pyridin-2-amine