Propentofylline
TL;DR: Propentofylline (CAS 55242-55-2) is a chemical compound with molecular formula C15H22N4O3 and molecular weight 306.1692 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-1-(5-oxohexyl)-7-propylpurine-2,6-dione
Also Known As: propentofylline, Hextol, Propentophylline, Karsivan, Propentofyllinum
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H22N4O3 |
| Molecular Weight | 306.1692 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 75.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 306.1692 Da |
| Heavy Atoms | 22 |
| Complexity | 454.0 |
| SMILES | CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(=O)C |
| InChIKey | RBQOQRRFDPXAGN-UHFFFAOYSA-N |
Product Description
Applications: Propentofylline is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Propentofylline (CAS 55242-55-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Propentofylline (CAS 55242-55-2) is a pharmaceutical intermediate with the molecular formula C15H22N4O3 and a molecular weight of 306.17 g/mol. It is also known as propentofylline and Hextol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Propentofylline
Property Insights of Propentofylline
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propentofylline. The TPSA of 75.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Propentofylline. Following Lipinski's Rule of Five, Propentofylline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Propentofylline?
The CAS number of Propentofylline is 55242-55-2.
What is the molecular formula of Propentofylline?
The molecular formula of Propentofylline is C15H22N4O3.
What is the molecular weight of Propentofylline?
The molecular weight of Propentofylline is 306.1692 g/mol.
What are the applications of Propentofylline?
Propentofylline is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Propentofylline (CAS 55242-55-2) with...
Where can I buy Propentofylline?
You can request a quote for Propentofylline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propentofylline?
Yes, CoreyChem provides custom synthesis services for Propentofylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.