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128924-99-2

128924-99-2 | 4-Quinolinamine, N-(1-methylethyl)-2-phenyl-

CAS No: 128924-99-2 Catalog No: AG000YK2 MDL No:

Product Description

Catalog Number:
AG000YK2
Chemical Name:
4-Quinolinamine, N-(1-methylethyl)-2-phenyl-
CAS Number:
128924-99-2
Molecular Formula:
C18H18N2
Molecular Weight:
262.3489
IUPAC Name:
2-phenyl-N-propan-2-ylquinolin-4-amine
InChI:
InChI=1S/C18H18N2/c1-13(2)19-18-12-17(14-8-4-3-5-9-14)20-16-11-7-6-10-15(16)18/h3-13H,1-2H3,(H,19,20)
InChI Key:
LMTXKFFRXGLJEU-UHFFFAOYSA-N
SMILES:
CC(Nc1cc(nc2c1cccc2)c1ccccc1)C

Properties

Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.147g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.356g/mol
Monoisotopic Mass:
262.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

Literature

Title Journal
Synthesis and quantitative structure-activity relationship analysis of 2-(aryl or heteroaryl)quinolin-4-amines, a new class of anti-HIV-1 agents. Journal of medicinal chemistry 19910501

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