Ethyl adenine-9-acetate
TL;DR: Ethyl adenine-9-acetate (CAS 25477-96-7) is a chemical compound with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(6-aminopurin-9-yl)acetate
Also Known As: ETHYL ADENINE-9-ACETATE, ethyl 2-(6-aminopurin-9-yl)acetate, Ethyl6-methylsalicylate, ethyl 2-(6-amino-9H-purin-9-yl)acetate, ethyl adenin-9-ylacetate
| Molecular Formula | C9H11N5O2 |
|---|---|
| Molecular Weight | 221.09 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.09128 |
| Heavy Atoms | 16 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 25477-96-7 |
|---|---|
| SMILES | CCOC(=O)CN1C=NC2=C(N=CN=C21)N |
| InChIKey | MCOVDURKZQNFBE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl adenine-9-acetate (CAS 25477-96-7), with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol. IUPAC: ethyl 2-(6-aminopurin-9-yl)acetate.
Chemical Property Profile of Ethyl adenine-9-acetate
Property Insights of Ethyl adenine-9-acetate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl adenine-9-acetate. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl adenine-9-acetate. Following Lipinski's Rule of Five, Ethyl adenine-9-acetate has 1 hydrogen bond donor(s) and 6 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 Ethyl adenine-9-acetate?
The CAS number of Ethyl adenine-9-acetate is 25477-96-7.
What is the molecular formula of Ethyl adenine-9-acetate?
The molecular formula of Ethyl adenine-9-acetate is C9H11N5O2.
What is the molecular weight of Ethyl adenine-9-acetate?
The molecular weight of Ethyl adenine-9-acetate is 221.09 g/mol.
Where can I buy Ethyl adenine-9-acetate?
You can request a quote for Ethyl adenine-9-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl adenine-9-acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl adenine-9-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.