8-(Ethylthio)-xanthine
TL;DR: 8-(Ethylthio)-xanthine (CAS 73840-29-6) is a chemical compound with molecular formula C7H8N4O2S and molecular weight 212.0368 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-ethylsulfanyl-3,7-dihydropurine-2,6-dione
Also Known As: 8-(Ethylthio)xanthine, Xanthine, 8-(ethylthio)-, 8-(Ethylthio)-xanthine, 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione, 8-(ethylsulfanyl)-3,7-dihydro-1h-purine-2,6-dione
Technical Specifications
| Molecular Formula | C7H8N4O2S |
| Molecular Weight | 212.0368 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.0368 Da |
| Heavy Atoms | 14 |
| Complexity | 272.0 |
| SMILES | CCSC1=NC2=C(N1)C(=O)NC(=O)N2 |
| InChIKey | SYTLDXNPGBQYRC-UHFFFAOYSA-N |
Chemical Property Profile of 8-(Ethylthio)-xanthine
Property Insights of 8-(Ethylthio)-xanthine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(Ethylthio)-xanthine. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(Ethylthio)-xanthine. Following Lipinski's Rule of Five, 8-(Ethylthio)-xanthine has 3 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 8-(Ethylthio)-xanthine?
The CAS number of 8-(Ethylthio)-xanthine is 73840-29-6.
What is the molecular formula of 8-(Ethylthio)-xanthine?
The molecular formula of 8-(Ethylthio)-xanthine is C7H8N4O2S.
What is the molecular weight of 8-(Ethylthio)-xanthine?
The molecular weight of 8-(Ethylthio)-xanthine is 212.0368 g/mol.
Where can I buy 8-(Ethylthio)-xanthine?
You can request a quote for 8-(Ethylthio)-xanthine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-(Ethylthio)-xanthine?
Yes, CoreyChem provides custom synthesis services for 8-(Ethylthio)-xanthine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.