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Ly404039

CAS No.:
635318-11-5
Catalog Number:
AG00ECE0
Molecular Formula:
C7H9NO6S
Molecular Weight:
235.2145
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
98%
In Stock USA
United States
$54
- +
5mg
98%
In Stock USA
United States
$107
- +
10mg
98%
In Stock USA
United States
$176
- +
25mg
98%
In Stock USA
United States
$366
- +
50mg
98%
In Stock USA
United States
$672
- +
Product Description
Catalog Number:
AG00ECE0
Chemical Name:
Ly404039
CAS Number:
635318-11-5
Molecular Formula:
C7H9NO6S
Molecular Weight:
235.2145
MDL Number:
MFCD11974011
IUPAC Name:
(1R,4S,5S,6S)-4-amino-2,2-dioxo-2λ6-thiabicyclo[3.1.0]hexane-4,6-dicarboxylic acid
InChI:
InChI=1S/C7H9NO6S/c8-7(6(11)12)1-15(13,14)4-2(3(4)7)5(9)10/h2-4H,1,8H2,(H,9,10)(H,11,12)/t2-,3-,4+,7+/m1/s1
InChI Key:
AVDUGNCTZRCAHH-MDASVERJSA-N
SMILES:
OC(=O)[C@@H]1[C@@H]2[C@H]1S(=O)(=O)C[C@@]2(N)C(=O)O
UNII:
531QUG7P9E
Properties
Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
235.015g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
235.21g/mol
Monoisotopic Mass:
235.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.8  
Literature
Title Journal
Effects of a novel mGlu₂/₃ receptor agonist prodrug, LY2140023 monohydrate, on central monoamine turnover as determined in human and rat cerebrospinal fluid. Psychopharmacology 20120201
Memantine-induced brain activation as a model for the rapid screening of potential novel antipsychotic compounds: exemplified by activity of an mGlu2/3 receptor agonist. Psychopharmacology 20110301
Reduced cAMP, Akt activation and p65-c-Rel dimerization: mechanisms involved in the protective effects of mGluR3 agonists in cultured astrocytes. PloS one 20110101
LY-2140023, a prodrug of the group II metabotropic glutamate receptor agonist LY-404039 for the potential treatment of schizophrenia. Current opinion in investigational drugs (London, England : 2000) 20100701
Glutamate agonist LY404,039 for treating schizophrenia has affinity for the dopamine D2(High) receptor. Synapse (New York, N.Y.) 20091001
Evidence for the role of metabotropic glutamate (mGlu)2 not mGlu3 receptors in the preclinical antipsychotic pharmacology of the mGlu2/3 receptor agonist (-)-(1R,4S,5S,6S)-4-amino-2-sulfonylbicyclo[3.1.0]hexane-4,6-dicarboxylic acid (LY404039). The Journal of pharmacology and experimental therapeutics 20080701
Glutamate agonists for schizophrenia stimulate dopamine D2High receptors. Schizophrenia research 20080201
Activation of mGlu2/3 receptors as a new approach to treat schizophrenia: a randomized Phase 2 clinical trial. Nature medicine 20070901
In vivo pharmacological characterization of the structurally novel, potent, selective mGlu2/3 receptor agonist LY404039 in animal models of psychiatric disorders. Psychopharmacology 20070701
Pharmacological and pharmacokinetic properties of a structurally novel, potent, and selective metabotropic glutamate 2/3 receptor agonist: in vitro characterization of agonist (-)-(1R,4S,5S,6S)-4-amino-2-sulfonylbicyclo[3.1.0]-hexane-4,6-dicarboxylic acid (LY404039). The Journal of pharmacology and experimental therapeutics 20070401
Synthesis and metabotropic glutamate receptor activity of S-oxidized variants of (-)-4-amino-2-thiabicyclo-[3.1.0]hexane-4,6-dicarboxylate: identification of potent, selective, and orally bioavailable agonists for mGlu2/3 receptors. Journal of medicinal chemistry 20070125
Properties