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LUF 6000

CAS No.:
890087-21-5
Catalog Number:
AG00GU41
Molecular Formula:
C22H20Cl2N4
Molecular Weight:
411.3270
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$607
- +
10mg
99%
1 week
United States
$882
- +
50mg
99%
1 week
United States
$1890
- +
100mg
99%
1 week
United States
$2990
- +
Product Description
Catalog Number:
AG00GU41
Chemical Name:
LUF 6000
CAS Number:
890087-21-5
Molecular Formula:
C22H20Cl2N4
Molecular Weight:
411.3270
MDL Number:
MFCD25541739
IUPAC Name:
2-cyclohexyl-N-(3,4-dichlorophenyl)-3H-imidazo[4,5-c]quinolin-4-amine
InChI:
InChI=1S/C22H20Cl2N4/c23-16-11-10-14(12-17(16)24)25-22-20-19(15-8-4-5-9-18(15)26-22)27-21(28-20)13-6-2-1-3-7-13/h4-5,8-13H,1-3,6-7H2,(H,25,26)(H,27,28)
InChI Key:
UWJVRSIGHHSDSJ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1Cl)Nc1nc2ccccc2c2c1[nH]c(n2)C1CCCCC1
Properties
Complexity:
529  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.107g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
411.33g/mol
Monoisotopic Mass:
410.107g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1  
Literature
Title Journal
Medicinal chemistry of A₃ adenosine receptor modulators: pharmacological activities and therapeutic implications. Journal of medicinal chemistry 20120628
Novel 2- and 4-substituted 1H-imidazo[4,5-c]quinolin-4-amine derivatives as allosteric modulators of the A3 adenosine receptor. Journal of medicinal chemistry 20090409
A series of 2,4-disubstituted quinolines as a new class of allosteric enhancers of the adenosine A3 receptor. Journal of medicinal chemistry 20090226
Flexible modulation of agonist efficacy at the human A3 adenosine receptor by the imidazoquinoline allosteric enhancer LUF6000. BMC pharmacology 20080101
Structure-activity relationships of new 1H-imidazo[4,5-c]quinolin-4-amine derivatives as allosteric enhancers of the A3 adenosine receptor. Journal of medicinal chemistry 20060601
Properties