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ADORA2A/PDE4D-IN-1

CAT: 0931-T204528-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T204528-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1321513-73-8
Target
PDE, Adenosine Receptor
Related Pathways
Neuroscience, GPCR/G Protein, Metabolism
Bioactivity
ADORA2A/PDE4D-IN-1 (Compound 9) is a dual inhibitor of the adenosine A2a receptor (ADORA2A) and phosphodiesterase 4D (PDE4D) . This compound is applicable for research in bronchial asthma.
Smiles
N1=NC(=C(N=C1N)C=2C=CC=CC2)C3=CC=NC=C3
Molecular Formula
C14H11N5
Molecular Weight
249.271
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Adora2A/pde4D-IN-1
CAS Number1321513-73-8
PubChem CID67363077
IUPAC Name5-phenyl-6-pyridin-4-yl-1,2,4-triazin-3-amine
Molecular FormulaC14H11N5
Molecular Weight249.27
XLogP1.1
Topological Polar Surface Area77.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity273
SMILES
C1=CC=C(C=C1)C2=C(N=NC(=N2)N)C3=CC=NC=C3
InChI
InChI=1S/C14H11N5/c15-14-17-12(10-4-2-1-3-5-10)13(18-19-14)11-6-8-16-9-7-11/h1-9H,(H2,15,17,19)
InChIKey
CTRSWEIROKNMCC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Adora2A/pde4D-IN-1
CAS: 1321513-73-8
CID: 67363077
Formula: C14H11N5
MW: 249.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight249.27
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass249.10144537
Monoisotopic Mass249.10144537
Topological Polar Surface Area77.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity273
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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Alternative Products

CatalogName
HY-170397ADORA2A/PDE4D-IN-1
BZ0060-2PcDNA3.1-ADORA2A
HY-173290PDE4D inhibitor 1
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327719-01PDE4D
YP-W19761-01Human PDE4D (PDE4D) ELISA Kit
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554586-01ADORA2A (Biotin)
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