Products for Research Use Only

BTB09089

CAT: 0013-GTR19211781-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211781-01Size:10 mg
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Description
BTB09089 is a selective agonist for the TDAG8/GPR65 receptor. It upregulates TDAG8 expression and modulates cytokine secretion in immune cells like T cells and macrophages, serving as a valuable research tool for studying GPR65's role in inflammatory and autoimmune disease models both in vitro and in vivo.
CAS Number
245728-44-3
Product Name Alternative
GPR65, GPR65 agonist, GPR65 agonist (BTB09089), DNA, BTB 09089, BTB09089, BTB-09089
Field of Research
Metabolism Research, Molecular Biology, Pharmacology & Drug Discovery
Purity
99.31% (May vary between batches)
Solubility
DMSO:14.7 mg/mL (37.95 mM)
Smiles
CN1C2=C (SC (SCC3=C (Cl) C=C (Cl) C=C3) =N1) C (=O) N (C) N=C2
Molecular Formula
C14H12Cl2N4OS2
Molecular Weight
387.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-[(2,4-Dichlorophenyl)methylsulfanyl]-1,6-dimethylpyridazino[4,5-e][1,3,4]thiadiazin-5-one
CAS Number245728-44-3
PubChem CID2801217
IUPAC Name3-[(2,4-dichlorophenyl)methylsulfanyl]-1,6-dimethylpyridazino[4,5-e][1,3,4]thiadiazin-5-one
Molecular FormulaC14H12Cl2N4OS2
Molecular Weight387.3
XLogP4
Topological Polar Surface Area98.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity595
SMILES
CN1C2=C(C(=O)N(N=C2)C)SC(=N1)SCC3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C14H12Cl2N4OS2/c1-19-11-6-17-20(2)13(21)12(11)23-14(18-19)22-7-8-3-4-9(15)5-10(8)16/h3-6H,7H2,1-2H3
InChIKey
PIAWQVCBQLTEIY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[(2,4-Dichlorophenyl)methylsulfanyl]-1,6-dimethylpyridazino[4,5-e][1,3,4]thiadiazin-5-one
CAS: 245728-44-3
CID: 2801217
Formula: C14H12Cl2N4OS2
MW: 387.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight387.3
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass385.9829588
Monoisotopic Mass385.9829588
Topological Polar Surface Area98.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity595
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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