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Home Other Building Blocks Alpha,alpha'-dianilino-p-xylene

Alpha,alpha'-dianilino-p-xylene

CAS No.:
13170-62-2
Catalog Number:
AG000ZMF
Molecular Formula:
C20H20N2
Molecular Weight:
288.3862
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(GC)
1 week
United States
$648
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Product Description
Catalog Number:
AG000ZMF
Chemical Name:
Alpha,alpha'-dianilino-p-xylene
CAS Number:
13170-62-2
Molecular Formula:
C20H20N2
Molecular Weight:
288.3862
MDL Number:
MFCD00143578
IUPAC Name:
N-[[4-(anilinomethyl)phenyl]methyl]aniline
InChI:
InChI=1S/C20H20N2/c1-3-7-19(8-4-1)21-15-17-11-13-18(14-12-17)16-22-20-9-5-2-6-10-20/h1-14,21-22H,15-16H2
InChI Key:
DXWQPWMYKQYRDS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)NCc1ccc(cc1)CNc1ccccc1
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.163g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
288.394g/mol
Monoisotopic Mass:
288.163g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Literature
Title Journal
Dipyrimidine amines: a novel class of chemokine receptor type 4 antagonists with high specificity. Journal of medicinal chemistry 20101223
Discovery of small molecule CXCR4 antagonists. Journal of medicinal chemistry 20071115
Properties