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Tecadenoson (CVT-510)

CAT: 0607-A9025-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-A9025-10Size:10 mg
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CAS Number
204512-90-3
Product Name Alternative
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(((R)-tetrahydrofuran-3-yl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
Sequence
CVT-510
Purity
0.98
Solubility
Soluble in DMSO
Smiles
O[C@H]([C@H](O)[C@@H](CO)O1)[C@@H]1N(C=N2)C3=C2C(N[C@H]4COCC4)=NC=N3
Molecular Formula
C14H19N5O5
Molecular Weight
337.34
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Tecadenoson

Tecadenoson is a novel selective A1 adenosine receptor agonist that is currently being evaluated for the conversion of paroxysmal supraventricular tachycardia (PSVT) to sinus rhythm. It is being developed by CV Therapeutics, Inc.

CAS Number204512-90-3
PubChem CID158795
IUPAC Name(2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[[(3R)-oxolan-3-yl]amino]purin-9-yl]oxolane-3,4-diol
Molecular FormulaC14H19N5O5
Molecular Weight337.33
XLogP-0.3
Topological Polar Surface Area135
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity446
SMILES
C1COC[C@@H]1NC2=C3C(=NC=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
InChI
InChI=1S/C14H19N5O5/c20-3-8-10(21)11(22)14(24-8)19-6-17-9-12(15-5-16-13(9)19)18-7-1-2-23-4-7/h5-8,10-11,14,20-22H,1-4H2,(H,15,16,18)/t7-,8-,10-,11-,14-/m1/s1
InChIKey
OESBDSFYJMDRJY-BAYCTPFLSA-N
Chemical Structure
2D Structure
2D structure of Tecadenoson
CAS: 204512-90-3
CID: 158795
Formula: C14H19N5O5
MW: 337.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight337.33
XLogP3-0.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass337.13861872
Monoisotopic Mass337.13861872
Topological Polar Surface Area135 Ų
Heavy Atom Count24
Formal Charge0
Complexity446
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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