2'-Deoxyadenosine 5'-O-thiophosphate sodium salt
TL;DR: 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt (CAS 64145-26-2) is a chemical compound with molecular formula C10H14N5O5PS and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(6-aminopurin-9-yl)-2-(dihydroxyphosphinothioyloxymethyl)oxolan-3-ol
Also Known As: 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt, US11185100, TABLE 7.10, 2'-Deoxyadenosine-5'-O-monophosphorothioate sodium salt, 2'-Deoxyadenosine 5'- (dihydrogen phosphorothioate), 2'-Deoxyadenosine 5'-(dihydrogen phosphorothioate)
| Molecular Formula | C10H14N5O5PS |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | -0.7174 |
| Topological Polar Surface Area | 148.77 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.04532 |
| Heavy Atoms | 22 |
| Complexity | 735.5656 |
Chemical Identifiers
| CAS Number | 64145-26-2 |
|---|---|
| SMILES | C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=S)(O)O)O |
Product Overview
2'-Deoxyadenosine 5'-O-thiophosphate sodium salt (CAS 64145-26-2), with molecular formula C10H14N5O5PS and molecular weight 347.05 g/mol. IUPAC: 5-(6-aminopurin-9-yl)-2-(dihydroxyphosphinothioyloxymethyl)oxolan-3-ol.
Chemical Property Profile of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt
Property Insights of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt
The XLogP value of -0.7174 indicates that 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.77 Ų indicates high polarity, suggesting 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt has 4 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 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt?
The CAS number of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt is 64145-26-2.
What is the molecular formula of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt?
The molecular formula of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt is C10H14N5O5PS.
What is the molecular weight of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt?
The molecular weight of 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt is 347.05 g/mol.
Where can I buy 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt?
You can request a quote for 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt?
Yes, KEHONG BIO provides custom synthesis services for 2'-Deoxyadenosine 5'-O-thiophosphate sodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.