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Home Aminos N-[(4-{[(Pyridin-2-yl)amino]methyl}phenyl)methyl]pyridin-2-amine

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

CAS No.:
55778-02-4
Catalog Number:
AG00DAB7
Molecular Formula:
C18H18N4
Molecular Weight:
290.3623
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$76
- +
5mg
99%
1 week
United States
$140
- +
10mg
99%
1 week
United States
$154
- +
50mg
99%
1 week
United States
$369
- +
100mg
99%
1 week
United States
$494
- +
Product Description
Catalog Number:
AG00DAB7
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
IUPAC Name:
N-[[4-[(pyridin-2-ylamino)methyl]phenyl]methyl]pyridin-2-amine
InChI:
InChI=1S/C18H18N4/c1-3-11-19-17(5-1)21-13-15-7-9-16(10-8-15)14-22-18-6-2-4-12-20-18/h1-12H,13-14H2,(H,19,21)(H,20,22)
InChI Key:
KBVFRXIGQQRMEF-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)NCc1ccc(cc1)CNc1ccccn1
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.153g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
290.37g/mol
Monoisotopic Mass:
290.153g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Dipyrimidine amines: a novel class of chemokine receptor type 4 antagonists with high specificity. Journal of medicinal chemistry 20101223
2,2'-[p-Phenyl-enebis(methyl-idene-aza-ne-di-yl)]dipyridinium bis-(hydrogensulfate) dihydrate. Acta crystallographica. Section E, Structure reports online 20101201
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. Dalton transactions (Cambridge, England : 2003) 20101114
Discovery of small molecule CXCR4 antagonists. Journal of medicinal chemistry 20071115
Properties