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1，3-Dimethyl-1H-pyrrolo[3，2-d]pyrimidine-2，4(3H，5H)-dione - ≥98%, high purity , CAS No.46155-89-9

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1，3-Dimethyl-1H-pyrrolo[3，2-d]pyrimidine-2，4(3H，5H)-dione - ≥98%, high purity , CAS No.46155-89-9

≥98%

CAS#: 46155-89-9 View More⌵
Molecular Weight: 179.18
PubChem CID: 206249

Item Number

D696327

Grouped product items
SKU	Size	Availability	Price	Qty
D696327-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$116.90	+-

Basic Description

Specifications & Purity	≥98%

AI Insight

Associated Targets(Human)

ADORA1 Tclin Adenosine A1 receptor (17603 Activities)

Discover Target: ADORA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Adora2b Adenosine A2 receptor (1828 Activities)

Discover Target: Adora2b

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

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Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	1,3-dimethyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione
INCHI	InChI=1S/C8H9N3O2/c1-10-5-3-4-9-6(5)7(12)11(2)8(10)13/h3-4,9H,1-2H3
InChi Key	XLSXPKZIKMPZHK-UHFFFAOYSA-N
Canonical SMILES	CN1C2=C(C(=O)N(C1=O)C)NC=C2
Isomeric SMILES	CN1C2=C(C(=O)N(C1=O)C)NC=C2
PubChem CID	206249
Molecular Weight	179.18

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	179.180 g/mol
XLogP3	-0.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	179.069 Da
Monoisotopic Mass	179.069 Da
Topological Polar Surface Area	56.400 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	266.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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