BTB09089

CAT: 0931-T67892-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0931-T67892-01Size:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

245728-44-3

Target

Others, GPCR, DNA

Related Pathways

DNA Damage/DNA Repair, GPCR/G Protein, Endocrinology/Hormones, Others

Purity

>99.99%

Bioactivity

BTB09089 (GPR65 agonist) is a T cell death-associated gene 8 (TDAG8/GPR65) -specific agonist.BTB09089 induces TDAG8 expression and regulates cytokine production in T cells and macrophages.

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

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

3-[(2,4-Dichlorophenyl)methylsulfanyl]-1,6-dimethylpyridazino[4,5-e][1,3,4]thiadiazin-5-one

CAS Number	245728-44-3
PubChem CID	2801217
IUPAC Name	3-[(2,4-dichlorophenyl)methylsulfanyl]-1,6-dimethylpyridazino[4,5-e][1,3,4]thiadiazin-5-one
Molecular Formula	C14H12Cl2N4OS2
Molecular Weight	387.3
XLogP	4
Topological Polar Surface Area	98.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	23
Formal Charge	0
Complexity	595

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

CAS: 245728-44-3

CID: 2801217

Formula: C14H12Cl2N4OS2

MW: 387.3

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	387.3
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	385.9829588
Monoisotopic Mass	385.9829588
Topological Polar Surface Area	98.9 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	595
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
BUP07258-01	BTB09089

BTB09089

Chemical Information

Alternative Products

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