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CAY10786

CAT: 0013-GTR19171100-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19171100-01Size:2 mg
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Description
CAY10786 is a small molecule antagonist of GPR52 with an IC50 of 0.63 μM. This compound is a valuable research tool for investigating the role of GPR52 in neuropsychiatric disorders, enabling both in vitro binding studies and in vivo pharmacological research.
CAS Number
1239987-91-7
Product Name Alternative
HdhQ140, Huntington's disease, GPR52, GPR52 antagonist-1, inhibit, Inhibitor, CAY10786, CAY-10786, CAY 10786
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Purity
99.82% (May vary between batches)
Solubility
Chloroform:10 mg/mL (41.26 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:5 mg/mL (20.63 mM) ; DMSO:245 mg/mL (1010.98 mM)
Smiles
O=C (\C=C\CCc1ccccc1) c1cccs1
Molecular Formula
C15H14OS
Molecular Weight
242.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

GPR52 antagonist-1
CAS Number1239987-91-7
PubChem CID156588927
IUPAC Name(E)-5-phenyl-1-thiophen-2-ylpent-2-en-1-one
Molecular FormulaC15H14OS
Molecular Weight242.3
XLogP4.3
Topological Polar Surface Area45.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity266
SMILES
C1=CC=C(C=C1)CC/C=C/C(=O)C2=CC=CS2
InChI
InChI=1S/C15H14OS/c16-14(15-11-6-12-17-15)10-5-4-9-13-7-2-1-3-8-13/h1-3,5-8,10-12H,4,9H2/b10-5+
InChIKey
XUIAIACHIPOOHR-BJMVGYQFSA-N
Chemical Structure
2D Structure
2D structure of GPR52 antagonist-1
CAS: 1239987-91-7
CID: 156588927
Formula: C15H14OS
MW: 242.3
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight242.3
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass242.07653624
Monoisotopic Mass242.07653624
Topological Polar Surface Area45.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity266
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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