sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks GSK2190915

GSK2190915

CAS No.:
936350-00-4
Catalog Number:
AG00GU8J
Molecular Formula:
C38H43N3O4S
Molecular Weight:
637.8307
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$266
- +
10mg
98%
1 week
United States
$407
- +
50mg
98%
1 week
United States
$1437
- +
Product Description
Catalog Number:
AG00GU8J
Chemical Name:
GSK2190915
CAS Number:
936350-00-4
Molecular Formula:
C38H43N3O4S
Molecular Weight:
637.8307
MDL Number:
MFCD10567009
IUPAC Name:
3-[3-tert-butylsulfanyl-1-[[4-(6-ethoxypyridin-3-yl)phenyl]methyl]-5-[(5-methylpyridin-2-yl)methoxy]indol-2-yl]-2,2-dimethylpropanoic acid
InChI:
InChI=1S/C38H43N3O4S/c1-8-44-34-18-14-28(22-40-34)27-12-10-26(11-13-27)23-41-32-17-16-30(45-24-29-15-9-25(2)21-39-29)19-31(32)35(46-37(3,4)5)33(41)20-38(6,7)36(42)43/h9-19,21-22H,8,20,23-24H2,1-7H3,(H,42,43)
InChI Key:
DFQGDHBGRSTTHX-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cn1)c1ccc(cc1)Cn1c(CC(C(=O)O)(C)C)c(c2c1ccc(c2)OCc1ccc(cn1)C)SC(C)(C)C
UNII:
Y1NA96IX3T
Properties
Complexity:
966  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
637.297g/mol
Formal Charge:
0
Heavy Atom Count:
46  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
637.839g/mol
Monoisotopic Mass:
637.297g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8  
Literature
Title Journal
5-Lipoxygenase-activating protein (FLAP) inhibitors. Part 4: development of 3-[3-tert-butylsulfanyl-1-[4-(6-ethoxypyridin-3-yl)benzyl]-5-(5-methylpyridin-2-ylmethoxy)-1H-indol-2-yl]-2,2-dimethylpropionic acid (AM803), a potent, oral, once daily FLAP inhibitor. Journal of medicinal chemistry 20111208
Pharmacology of AM803, a novel selective five-lipoxygenase-activating protein (FLAP) inhibitor in rodent models of acute inflammation. European journal of pharmacology 20100825
Properties