Adefovir
TL;DR: Adefovir (CAS 106941-25-7) is a chemical compound with molecular formula C8H12N5O4P and molecular weight 273.06268 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-aminopurin-9-yl)ethoxymethylphosphonic acid
Also Known As: ADEFOVIR, PMEA, Adefovirum, 9-(2-Phosphonylmethoxyethyl)adenine, Adefovir/PMEA
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H12N5O4P |
| Molecular Weight | 273.06268 g/mol |
| XLogP | -2.0 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.06268 Da |
| Heavy Atoms | 18 |
| Complexity | 327.0 |
| Melting Point | >250 °C |
| Solubility | MW: 501.47. Off-white crystalline powder. Solubility in water (mg/mL): 19 (pH 2.0); 0.4 (pH 7.2); log Kow (octanol/aqueous phosphate buffer): 1.91 /Adefovir di(pivaloyloxymethyl) ester/ |
| SMILES | C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)N |
| InChIKey | SUPKOOSCJHTBAH-UHFFFAOYSA-N |
Chemical Property Profile of Adefovir
Property Insights of Adefovir
The XLogP value of -2.0 indicates that Adefovir is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Adefovir. Following Lipinski's Rule of Five, Adefovir has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Adefovir?
The CAS number of Adefovir is 106941-25-7.
What is the molecular formula of Adefovir?
The molecular formula of Adefovir is C8H12N5O4P.
What is the molecular weight of Adefovir?
The molecular weight of Adefovir is 273.06268 g/mol.
Where can I buy Adefovir?
You can request a quote for Adefovir directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Adefovir?
Yes, CoreyChem provides custom synthesis services for Adefovir and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.