Hydroxypropentofylline
TL;DR: Hydroxypropentofylline (CAS 104317-70-6) is a chemical compound with molecular formula C15H22N4O4 and molecular weight 322.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione
Also Known As: Hydroxypropentofylline, 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)-, 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)-3,7-dihydro-1H-purine-2,6-dione, RefChem:147256
| Molecular Formula | C15H22N4O4 |
|---|---|
| Molecular Weight | 322.16 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 322.1641 |
| Heavy Atoms | 23 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 104317-70-6 |
|---|---|
| SMILES | CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(=O)C)O |
| InChIKey | HNFYOKRWFUQBIE-UHFFFAOYSA-N |
Product Overview
Hydroxypropentofylline (CAS 104317-70-6), with molecular formula C15H22N4O4 and molecular weight 322.16 g/mol. IUPAC: 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione.
Chemical Property Profile of Hydroxypropentofylline
Property Insights of Hydroxypropentofylline
The XLogP value of -0.4 indicates that Hydroxypropentofylline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxypropentofylline. Following Lipinski's Rule of Five, Hydroxypropentofylline has 1 hydrogen bond donor(s) and 5 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 Hydroxypropentofylline?
The CAS number of Hydroxypropentofylline is 104317-70-6.
What is the molecular formula of Hydroxypropentofylline?
The molecular formula of Hydroxypropentofylline is C15H22N4O4.
What is the molecular weight of Hydroxypropentofylline?
The molecular weight of Hydroxypropentofylline is 322.16 g/mol.
Where can I buy Hydroxypropentofylline?
You can request a quote for Hydroxypropentofylline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxypropentofylline?
Yes, KEHONG BIO provides custom synthesis services for Hydroxypropentofylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.