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Ar 231453

CAS No.:
733750-99-7
Catalog Number:
AG00FBZB
Molecular Formula:
C21H24FN7O5S
Molecular Weight:
505.5226
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$176
- +
10mg
99%
1 week
United States
$237
- +
Product Description
Catalog Number:
AG00FBZB
Chemical Name:
Ar 231453
CAS Number:
733750-99-7
Molecular Formula:
C21H24FN7O5S
Molecular Weight:
505.5226
MDL Number:
MFCD14706714
IUPAC Name:
N-(2-fluoro-4-methylsulfonylphenyl)-5-nitro-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidin-4-amine
InChI:
InChI=1S/C21H24FN7O5S/c1-12(2)18-26-21(34-27-18)13-6-8-28(9-7-13)20-17(29(30)31)19(23-11-24-20)25-16-5-4-14(10-15(16)22)35(3,32)33/h4-5,10-13H,6-9H2,1-3H3,(H,23,24,25)
InChI Key:
DGBKNTVAKIFYNU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(ncnc1N1CCC(CC1)c1onc(n1)C(C)C)Nc1ccc(cc1F)S(=O)(=O)C
UNII:
07Z1P4981I
Properties
Complexity:
833  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
505.154g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
505.525g/mol
Monoisotopic Mass:
505.154g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
168A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Literature
Title Journal
Discovery of a second generation agonist of the orphan G-protein coupled receptor GPR119 with an improved profile. Bioorganic & medicinal chemistry letters 20120215
Stimulating β-cell replication and improving islet graft function by AR231453, A GPR119 agonist. Transplantation proceedings 20111101
Discovery of fused bicyclic agonists of the orphan G-protein coupled receptor GPR119 with in vivo activity in rodent models of glucose control. Bioorganic & medicinal chemistry letters 20110515
GPR119 regulates murine glucose homeostasis through incretin receptor-dependent and independent mechanisms. Endocrinology 20110201
Discovery of the first potent and orally efficacious agonist of the orphan G-protein coupled receptor 119. Journal of medicinal chemistry 20080911
A role for intestinal endocrine cell-expressed g protein-coupled receptor 119 in glycemic control by enhancing glucagon-like Peptide-1 and glucose-dependent insulinotropic Peptide release. Endocrinology 20080501
A role for beta-cell-expressed G protein-coupled receptor 119 in glycemic control by enhancing glucose-dependent insulin release. Endocrinology 20070601
Properties