Determine the necessary mass, volume, or concentration for preparing a solution.
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Regadenoson is a selective Adenosine A2A-R (A2A adenosine receptor) agonist in myocardial imaging.
| pKa | pKₐ: 13.07, pKₐ: 1.32 |
|---|---|
| Ki Data | Adenosine A2A-R: Ki= 290 nM (human); Adenosine A2A-R: Ki= 290 nM (rat); Adenosine A1-R: Ki>16.46 mM (human) |
| Pubchem Sid | 504757872 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504757872 |
| Canonical Smiles | CNC(=O)C1=CN(N=C1)C2=NC(=C3C(=N2)N(C=N3)C4C(C(C(O4)CO)O)O)N |
| IUPAC Name | 1-[6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-2-yl]-N-methylpyrazole-4-carboxamide |
| InChIKey | LZPZPHGJDAGEJZ-AKAIJSEGSA-N |
| INCHI | 1S/C15H18N8O5/c1-17-13(27)6-2-19-23(3-6)15-20-11(16)8-12(21-15)22(5-18-8)14-10(26)9(25)7(4-24)28-14/h2-3,5,7,9-10,14,24-26H,4H2,1H3,(H,17,27)(H2,16,20,21)/t7-,9-,10-,14-/m1/s1 |
| Isomeric SMILES | CNC(=O)C1=CN(N=C1)C2=NC(=C3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
| Alternate CAS | 875148-45-1 |
| Molecular Weight | 390.35 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Apr 03, 2025 | R335710 | |
| Certificate of Analysis | Apr 03, 2025 | R335710 | |
| Certificate of Analysis | Apr 03, 2025 | R335710 | |
| Certificate of Analysis | Apr 03, 2025 | R335710 |
| Solubility | Soluble in DMSO, and methanol. |
|---|---|
| Refractive Index | n20D1.90 (Predicted) |
| Boil Point(°C) | 744.10° C (Predicted) |
| Melt Point(°C) | 194-196° C |
| Molecular Weight | 390.350 g/mol |
| XLogP3 | -1.500 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 4 |
| Exact Mass | 390.14 Da |
| Monoisotopic Mass | 390.14 Da |
| Topological Polar Surface Area | 186.000 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 587.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| 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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