Adenosine 5'-phosphoroimidazolide
TL;DR: Adenosine 5'-phosphoroimidazolide (CAS 23723-40-2) is a chemical compound with molecular formula C13H16N7O6P and molecular weight 397.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid
Also Known As: Adenosine 5'-phosphoroimidazolide, adenosine5'-phosphoroimidazolide, 1-(5 -Adenylyl)-1H-imidazole, 5'-o-[hydroxy(1h-imidazol-1-yl)phosphoryl]adenosine, Adenosine, 5'-(hydrogen 1H-imidazol-1-ylphosphonate)
| Molecular Formula | C13H16N7O6P |
|---|---|
| Molecular Weight | 397.09 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.08997 |
| Heavy Atoms | 27 |
| Complexity | 589.0 |
Chemical Identifiers
| CAS Number | 23723-40-2 |
|---|---|
| SMILES | C1=CN(C=N1)P(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O |
| InChIKey | ZZVDSVGETAFWNA-QYVSTXNMSA-N |
Product Overview
Adenosine 5'-phosphoroimidazolide (CAS 23723-40-2), with molecular formula C13H16N7O6P and molecular weight 397.09 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid.
Chemical Property Profile of Adenosine 5'-phosphoroimidazolide
Property Insights of Adenosine 5'-phosphoroimidazolide
The XLogP value of -2.9 indicates that Adenosine 5'-phosphoroimidazolide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 184.0 Ų indicates high polarity, suggesting Adenosine 5'-phosphoroimidazolide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine 5'-phosphoroimidazolide has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adenosine 5'-phosphoroimidazolide?
The CAS number of Adenosine 5'-phosphoroimidazolide is 23723-40-2.
What is the molecular formula of Adenosine 5'-phosphoroimidazolide?
The molecular formula of Adenosine 5'-phosphoroimidazolide is C13H16N7O6P.
What is the molecular weight of Adenosine 5'-phosphoroimidazolide?
The molecular weight of Adenosine 5'-phosphoroimidazolide is 397.09 g/mol.
Where can I buy Adenosine 5'-phosphoroimidazolide?
You can request a quote for Adenosine 5'-phosphoroimidazolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenosine 5'-phosphoroimidazolide?
Yes, KEHONG BIO provides custom synthesis services for Adenosine 5'-phosphoroimidazolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.