O-Ethyl Adefovir
TL;DR: O-Ethyl Adefovir (CAS 116384-54-4) is a chemical compound with molecular formula C10H16N5O4P and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-aminopurin-9-yl)ethoxymethyl-ethoxyphosphinic acid
Also Known As: O-Ethyl Adefovir, O-EthylAdefovir, Adefovir Impurity 6, Adefovir Impurity 21, Ethyl-9-[2-(phosphonomethoxy)ethyl]adenine
| Molecular Formula | C10H16N5O4P |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 301.094 |
| Heavy Atoms | 20 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 116384-54-4 |
|---|---|
| SMILES | CCOP(=O)(COCCN1C=NC2=C(N=CN=C21)N)O |
| InChIKey | MRBIAWVMKIZTRX-UHFFFAOYSA-N |
Product Overview
O-Ethyl Adefovir (CAS 116384-54-4), with molecular formula C10H16N5O4P and molecular weight 301.09 g/mol. IUPAC: 2-(6-aminopurin-9-yl)ethoxymethyl-ethoxyphosphinic acid.
Chemical Property Profile of O-Ethyl Adefovir
Property Insights of O-Ethyl Adefovir
The XLogP value of -1.1 indicates that O-Ethyl Adefovir is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for O-Ethyl Adefovir. Following Lipinski's Rule of Five, O-Ethyl Adefovir has 2 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 O-Ethyl Adefovir?
The CAS number of O-Ethyl Adefovir is 116384-54-4.
What is the molecular formula of O-Ethyl Adefovir?
The molecular formula of O-Ethyl Adefovir is C10H16N5O4P.
What is the molecular weight of O-Ethyl Adefovir?
The molecular weight of O-Ethyl Adefovir is 301.09 g/mol.
Where can I buy O-Ethyl Adefovir?
You can request a quote for O-Ethyl Adefovir directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Ethyl Adefovir?
Yes, KEHONG BIO provides custom synthesis services for O-Ethyl Adefovir and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.