Products for Research Use Only
RegisterLogin

A1/A3 AR antagonist 3

CAT: 0013-GTR19218806-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19218806-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
A1/A3 AR Antagonist 3 is a potent dual adenosine A1 and A3 receptor antagonist with low-micromolar to nanomolar affinity. It is a valuable research tool for investigating chronic heart disease mechanisms, applicable in both in vitro binding assays and in vivo cardiovascular models.
CAS Number
2665804-57-7
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
N (C1=C2C (C (=NN2) C3=CC=CC=C3) =CC (C#N) =N1) C4=CC (OC) =C (OC) C (OC) =C4
Molecular Formula
C22H19N5O3
Molecular Weight
401.42
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

A1/A3 AR antagonist 3
CAS Number2665804-57-7
PubChem CID167312186
IUPAC Name3-phenyl-7-(3,4,5-trimethoxyanilino)-1H-pyrazolo[5,4-c]pyridine-5-carbonitrile
Molecular FormulaC22H19N5O3
Molecular Weight401.4
XLogP4
Topological Polar Surface Area105
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity593
SMILES
COC1=CC(=CC(=C1OC)OC)NC2=NC(=CC3=C2NN=C3C4=CC=CC=C4)C#N
InChI
InChI=1S/C22H19N5O3/c1-28-17-10-14(11-18(29-2)21(17)30-3)24-22-20-16(9-15(12-23)25-22)19(26-27-20)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,24,25)(H,26,27)
InChIKey
QGDXZJBGCQOZLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of A1/A3 AR antagonist 3
CAS: 2665804-57-7
CID: 167312186
Formula: C22H19N5O3
MW: 401.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight401.4
XLogP34
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass401.14878949
Monoisotopic Mass401.14878949
Topological Polar Surface Area105 Ų
Heavy Atom Count30
Formal Charge0
Complexity593
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

Related Products

CatalogName
GTR19186782-01A1/A3 AR antagonist 2
GTR19186480-01A1/A3 AR antagonist 1
GTR19221097-01A2A/A3 AR antagonist-1
GTR19187732-01A2A/A1 AR antagonist-1
GTR19249359-01AR antagonist 10
GTR19241366-01AR antagonist 9
GTR19235601-01AR antagonist 7
GTR19186412-01AR antagonist 2
GTR19263701-01AR antagonist 12
GTR19216975-01AR antagonist 1

Alternative Products

CatalogName
HY-146478A1/A3 AR antagonist 1
T61744-01A1/A3 AR antagonist 2
MBS5820688A1/A3 AR antagonist 3
TBI2673-500MGUrapidil, Adrenergic a1 antagonist
HY-147541A2A/A3 AR antagonist-1
MBS5816550A2A/A3 AR antagonist-1
TBI1114-250MGPrazosin HCl, a1 adrenergic antagonist
T22466-01Adenosine receptor A1 antagonist 5
T60732-01A2A/A1 AR antagonist-1
217150Adenosine A1 Receptor Antagonist I, DPCPX (8-Cyclopentyl-1,3-dipropylxanthine, CPX, PD-116,948)

Popular Products