Adenosine 3',5'-cyclic methylphosphonothioate
TL;DR: Adenosine 3',5'-cyclic methylphosphonothioate (CAS 130320-50-2) is a chemical compound with molecular formula C11H14N5O4PS and molecular weight 343.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,5R)-5-(6-aminopurin-9-yl)-2-[[hydroxy(methyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-3-ol
Also Known As: Acmptn, Adenosine 3',5'-cyclic methylphosphonothioate, Adenosine, cyclic 3',5'-(methylphosphonothioate), Adenosine,cyclic 3',5'-(methylphosphonothioate), (2R,5R)-5-(6-aminopurin-9-yl)-2-[[hydroxy(methyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-3-ol
| Molecular Formula | C11H14N5O4PS |
|---|---|
| Molecular Weight | 343.05 g/mol |
| LogP | 0.696 |
| Topological Polar Surface Area | 128.54 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.0504 |
| Heavy Atoms | 22 |
| Complexity | 787.88043 |
Chemical Identifiers
| CAS Number | 130320-50-2 |
|---|---|
| SMILES | CP(=S)(O)OC[C@@H]1C(=C[C@@H](O1)N2C=NC3=C(N=CN=C32)N)O |
Product Overview
Adenosine 3',5'-cyclic methylphosphonothioate (CAS 130320-50-2), with molecular formula C11H14N5O4PS and molecular weight 343.05 g/mol. IUPAC: (2R,5R)-5-(6-aminopurin-9-yl)-2-[[hydroxy(methyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-3-ol.
Chemical Property Profile of Adenosine 3',5'-cyclic methylphosphonothioate
Property Insights of Adenosine 3',5'-cyclic methylphosphonothioate
The XLogP value of 0.696 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adenosine 3',5'-cyclic methylphosphonothioate. The TPSA of 128.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Adenosine 3',5'-cyclic methylphosphonothioate. Following Lipinski's Rule of Five, Adenosine 3',5'-cyclic methylphosphonothioate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adenosine 3',5'-cyclic methylphosphonothioate?
The CAS number of Adenosine 3',5'-cyclic methylphosphonothioate is 130320-50-2.
What is the molecular formula of Adenosine 3',5'-cyclic methylphosphonothioate?
The molecular formula of Adenosine 3',5'-cyclic methylphosphonothioate is C11H14N5O4PS.
What is the molecular weight of Adenosine 3',5'-cyclic methylphosphonothioate?
The molecular weight of Adenosine 3',5'-cyclic methylphosphonothioate is 343.05 g/mol.
Where can I buy Adenosine 3',5'-cyclic methylphosphonothioate?
You can request a quote for Adenosine 3',5'-cyclic methylphosphonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenosine 3',5'-cyclic methylphosphonothioate?
Yes, KEHONG BIO provides custom synthesis services for Adenosine 3',5'-cyclic methylphosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.