8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)
TL;DR: 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) (CAS 370077-00-2) is a chemical compound with molecular formula C16H18N8O4S2 and molecular weight 450.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(3,7-dimethyl-2,6-dioxopurin-8-yl)sulfanylethylsulfanyl]-3,7-dimethylpurine-2,6-dione
Also Known As: 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione), 8,8'-(ethane-1,2-diyldisulfanediyl)bis(3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione), 8-[2-(3,7-dimethyl-2,6-dioxo-purin-8-yl)sulfanylethylsulfanyl]-3,7-dimethyl-purine-2,6-dione, 8-[2-(3,7-dimethyl-2,6-dioxopurin-8-yl)sulfanylethylsulfanyl]-3,7-dimethylpurine-2,6-dione
| Molecular Formula | C16H18N8O4S2 |
|---|---|
| Molecular Weight | 450.09 g/mol |
| LogP | -0.8816 |
| Topological Polar Surface Area | 145.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.08923 |
| Heavy Atoms | 30 |
| Complexity | 1417.862 |
Chemical Identifiers
| CAS Number | 370077-00-2 |
|---|---|
| SMILES | CN1C2=C(N=C1SCCSC3=NC4=C(N3C)C(=O)NC(=O)N4C)N(C(=O)NC2=O)C |
Product Overview
8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) (CAS 370077-00-2), with molecular formula C16H18N8O4S2 and molecular weight 450.09 g/mol. IUPAC: 8-[2-(3,7-dimethyl-2,6-dioxopurin-8-yl)sulfanylethylsulfanyl]-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)
Property Insights of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)
The XLogP value of -0.8816 indicates that 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.36 Ų indicates high polarity, suggesting 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) 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 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)?
The CAS number of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) is 370077-00-2.
What is the molecular formula of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)?
The molecular formula of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) is C16H18N8O4S2.
What is the molecular weight of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)?
The molecular weight of 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) is 450.09 g/mol.
Where can I buy 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)?
You can request a quote for 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)?
Yes, KEHONG BIO provides custom synthesis services for 8,8'-(ethane-1,2-diylbis(sulfanediyl))bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.