1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate
TL;DR: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate (CAS 86256-99-7) is a chemical compound with molecular formula C15H24N4O4 and molecular weight 324.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(5,6-dihydroxyhexyl)-1,3-diethylpurine-2,6-dione
Also Known As: 1,3-Diethyl-7-(5,6-dihydroxyhexyl)xanthine hydrate, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate, 3,7-Dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-1H-purine-2,6-dione hydrate, 7-(5,6-dihydroxyhexyl)-1,3-diethylpurine-2,6-dione, 7-(5,6-Dihydroxyhexyl)-1,3-diethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C15H24N4O4 |
|---|---|
| Molecular Weight | 324.18 g/mol |
| LogP | -0.077 |
| Topological Polar Surface Area | 102.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 324.17975 |
| Heavy Atoms | 23 |
| Complexity | 774.10046 |
Chemical Identifiers
| CAS Number | 86256-99-7 |
|---|---|
| SMILES | CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CCCCC(CO)O |
Product Overview
1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate (CAS 86256-99-7), with molecular formula C15H24N4O4 and molecular weight 324.18 g/mol. IUPAC: 7-(5,6-dihydroxyhexyl)-1,3-diethylpurine-2,6-dione.
Chemical Property Profile of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate
Property Insights of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate
The XLogP value of -0.077 indicates that 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate. Following Lipinski's Rule of Five, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate has 2 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 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate?
The CAS number of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate is 86256-99-7.
What is the molecular formula of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate?
The molecular formula of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate is C15H24N4O4.
What is the molecular weight of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate?
The molecular weight of 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate is 324.18 g/mol.
Where can I buy 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate?
You can request a quote for 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-(5,6-dihydroxyhexyl)-, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.