Adenosine 5'-(toluene-4-sulphonate)
TL;DR: Adenosine 5'-(toluene-4-sulphonate) (CAS 5135-30-8) is a chemical compound with molecular formula C17H19N5O6S and molecular weight 421.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl 4-methylbenzenesulfonate
Also Known As: 5'-Tosyladenosine, 5'-Tosyl Adenosine, (3xi)-5'-o-[(4-methylphenyl)sulfonyl]adenosine, Adenosine 5'-(toluene-4-sulphonate), 5'-Tosyladenosine, 98% - 1G 1g
| Molecular Formula | C17H19N5O6S |
|---|---|
| Molecular Weight | 421.11 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.1056 |
| Heavy Atoms | 29 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 5135-30-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2C([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O |
| InChIKey | CAXLRAROZXYOHH-OPJKZUAWSA-N |
Product Overview
Adenosine 5'-(toluene-4-sulphonate) (CAS 5135-30-8), with molecular formula C17H19N5O6S and molecular weight 421.11 g/mol. IUPAC: [(2R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl 4-methylbenzenesulfonate.
Chemical Property Profile of Adenosine 5'-(toluene-4-sulphonate)
Property Insights of Adenosine 5'-(toluene-4-sulphonate)
The XLogP value of -0.4 indicates that Adenosine 5'-(toluene-4-sulphonate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 171.0 Ų indicates high polarity, suggesting Adenosine 5'-(toluene-4-sulphonate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine 5'-(toluene-4-sulphonate) has 3 hydrogen bond donor(s) and 10 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 5'-(toluene-4-sulphonate)?
The CAS number of Adenosine 5'-(toluene-4-sulphonate) is 5135-30-8.
What is the molecular formula of Adenosine 5'-(toluene-4-sulphonate)?
The molecular formula of Adenosine 5'-(toluene-4-sulphonate) is C17H19N5O6S.
What is the molecular weight of Adenosine 5'-(toluene-4-sulphonate)?
The molecular weight of Adenosine 5'-(toluene-4-sulphonate) is 421.11 g/mol.
Where can I buy Adenosine 5'-(toluene-4-sulphonate)?
You can request a quote for Adenosine 5'-(toluene-4-sulphonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenosine 5'-(toluene-4-sulphonate)?
Yes, KEHONG BIO provides custom synthesis services for Adenosine 5'-(toluene-4-sulphonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.