((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate
TL;DR: ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate (CAS 215942-59-9) is a chemical compound with molecular formula C11H19N6O13P3 and molecular weight 536.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3R,4R,5R)-5-(2,6-diaminopurin-9-yl)-3-hydroxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate
| Molecular Formula | C11H19N6O13P3 |
|---|---|
| Molecular Weight | 536.02 g/mol |
| LogP | -1.3927 |
| Topological Polar Surface Area | 294.15 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 536.0223 |
| Heavy Atoms | 33 |
| Complexity | 1170.3959 |
Chemical Identifiers
| CAS Number | 215942-59-9 |
|---|---|
| SMILES | CO[C@@H]1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=C(N=C32)N)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O |
Product Overview
((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate (CAS 215942-59-9), with molecular formula C11H19N6O13P3 and molecular weight 536.02 g/mol. IUPAC: [[(2R,3R,4R,5R)-5-(2,6-diaminopurin-9-yl)-3-hydroxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate
Property Insights of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate
The XLogP value of -1.3927 indicates that ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 294.15 Ų indicates high polarity, suggesting ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate?
The CAS number of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate is 215942-59-9.
What is the molecular formula of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate?
The molecular formula of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate is C11H19N6O13P3.
What is the molecular weight of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate?
The molecular weight of ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate is 536.02 g/mol.
Where can I buy ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate?
You can request a quote for ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate?
Yes, KEHONG BIO provides custom synthesis services for ((2R,3R,4R,5R)-5-(2,6-Diamino-9H-purin-9-yl)-3-hydroxy-4-methoxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.