Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate
TL;DR: Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate (CAS 35965-93-6) is a chemical compound with molecular formula C11H13N5O5 and molecular weight 295.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxylate
Also Known As: Adenosin-5'-uronsaeuremethylester, adenosine-5'-carboxylic acid methyl ester, 9-(5-Methylpentofuranosyluronosyl)-9H-purin-6-amine, 9h-purin-6-amine, 9-(5-methylpentofuranuronosyl)-, methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate
| Molecular Formula | C11H13N5O5 |
|---|---|
| Molecular Weight | 295.09 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.09167 |
| Heavy Atoms | 21 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 35965-93-6 |
|---|---|
| SMILES | COC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | BSIFNWLUZWFSOL-UHFFFAOYSA-N |
Product Overview
Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate (CAS 35965-93-6), with molecular formula C11H13N5O5 and molecular weight 295.09 g/mol. IUPAC: methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxylate.
Chemical Property Profile of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate
Property Insights of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate
The XLogP value of -0.5 indicates that Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate has 3 hydrogen bond donor(s) and 9 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 Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate?
The CAS number of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate is 35965-93-6.
What is the molecular formula of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate?
The molecular formula of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate is C11H13N5O5.
What is the molecular weight of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate?
The molecular weight of Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate is 295.09 g/mol.
Where can I buy Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate?
You can request a quote for Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.