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LY2828360

CAT: 0013-GTR19157313-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19157313-02Size:500 mg
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Description
LY2828360 is a cannabinoid (CB) receptor 2 agonist (Ki = 40.3 nM) . It selectively activates CB2 over CB1 in a GTPγS binding assay (EC50s = 20.1 and >100000 nM respectively) . (In Vivo) :In WT mice, acute systemic administration of LY2828360 suppresses paclitaxel-induced mechanical and cold allodynia in a dose-dependent manner. LY2828360 produces time-dependent suppressions of paclitaxel-evoked mechanical and cold hypersensitivities and suppression of allodynia is maintained for at least 4.5 h post-injection relative to drug pre-injection levels. At 24 h post-injection, paclitaxel-induced mechanical allodynia has returned to drug pre-injection levels of hypersensitivity. Residual suppression of cold allodynia was absent by 72 h post LY2828360 treatment. Previously chronic administration of LY2828360 blocks the development of tolerance to the antiallodynic effects of morphine in WT but not in CB2KO mice. Chronic LY2828360 treatment suppresses paclitaxel-induced mechanical and cold allodynia in WT mice but not in CB2KO mice previously render tolerant to morphine.
CAS Number
1231220-79-3
Purity
>98% (HPLC)
Solubility
DMSO:20.83 mg/mL (48.79 mM)
Smiles
CN1CCN (CC1) c1nc (C) nc2n (C3CCOCC3) c (nc12) -c1ccccc1Cl
Molecular Formula
C22H27ClN6O
Molecular Weight
426.94
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
8- (2-Chloro-phenyl) -2-methyl-6- (4-methyl-piperazin-1-yl) -9- (tetrahydro-pyran-4-yl) -9H-purine

Chemical Information

Ly2828360

LY2828360 is under investigation in clinical trial NCT01319929 (A Study of LY2828360 in Patients With Osteoarthritic Knee Pain).

CAS Number1231220-79-3
PubChem CID46833780
IUPAC Name8-(2-chlorophenyl)-2-methyl-6-(4-methylpiperazin-1-yl)-9-(oxan-4-yl)purine
Molecular FormulaC22H27ClN6O
Molecular Weight426.9
XLogP3.3
Topological Polar Surface Area59.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count30
Formal Charge0
Complexity570
SMILES
CC1=NC2=C(C(=N1)N3CCN(CC3)C)N=C(N2C4CCOCC4)C5=CC=CC=C5Cl
InChI
InChI=1S/C22H27ClN6O/c1-15-24-21(28-11-9-27(2)10-12-28)19-22(25-15)29(16-7-13-30-14-8-16)20(26-19)17-5-3-4-6-18(17)23/h3-6,16H,7-14H2,1-2H3
InChIKey
UCMNDPDJRSEZPL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ly2828360
CAS: 1231220-79-3
CID: 46833780
Formula: C22H27ClN6O
MW: 426.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight426.9
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass426.1934872
Monoisotopic Mass426.1934872
Topological Polar Surface Area59.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity570
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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