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Q203

CAS No.:
1334719-95-7
Catalog Number:
AG009Y07
Molecular Formula:
C29H28ClF3N4O2
Molecular Weight:
557.0064
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
99%
1 week
United States
$240
- +
5mg
99%
1 week
United States
$607
- +
10mg
99%
1 week
United States
$890
- +
50mg
99%
1 week
United States
$2557
- +
100mg
99%
1 week
United States
$3557
- +
Product Description
Catalog Number:
AG009Y07
Chemical Name:
Q203
CAS Number:
1334719-95-7
Molecular Formula:
C29H28ClF3N4O2
Molecular Weight:
557.0064
MDL Number:
MFCD28502122
IUPAC Name:
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
InChI:
InChI=1S/C29H28ClF3N4O2/c1-2-25-27(37-18-22(30)7-12-26(37)35-25)28(38)34-17-19-3-8-23(9-4-19)36-15-13-21(14-16-36)20-5-10-24(11-6-20)39-29(31,32)33/h3-12,18,21H,2,13-17H2,1H3,(H,34,38)
InChI Key:
OJICYBSWSZGRFB-UHFFFAOYSA-N
SMILES:
CCc1nc2n(c1C(=O)NCc1ccc(cc1)N1CCC(CC1)c1ccc(cc1)OC(F)(F)F)cc(cc2)Cl
UNII:
55G92WGH3X
Properties
Complexity:
796  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
556.185g/mol
Formal Charge:
0
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
557.014g/mol
Monoisotopic Mass:
556.185g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9  
Literature
Title Journal
Synthesis and structure-activity relationships of novel fused ring analogues of Q203 as antitubercular agents. European journal of medicinal chemistry 20170818
Properties