7,9-Dihydro-1H-purine-2,6,8(3H)-trithione
TL;DR: 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione (CAS 15986-33-1) is a chemical compound with molecular formula C5H4N4S3 and molecular weight 215.95981 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7,9-dihydro-3H-purine-2,6,8-trithione
Also Known As: trithiouric acid, Trithioharnsaeure, trithio uric acid, 2,6,8-trithiopurine, 9H-purine-2,6,8-trithiol
Technical Specifications
| Molecular Formula | C5H4N4S3 |
| Molecular Weight | 215.95981 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.95981 Da |
| Heavy Atoms | 12 |
| Complexity | 332.0 |
| SMILES | C12=C(NC(=S)N1)NC(=S)NC2=S |
| InChIKey | ITERHBFDXIEMFW-UHFFFAOYSA-N |
Chemical Property Profile of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione
Property Insights of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione
The XLogP value of -0.1 indicates that 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione?
The CAS number of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione is 15986-33-1.
What is the molecular formula of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione?
The molecular formula of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione is C5H4N4S3.
What is the molecular weight of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione?
The molecular weight of 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione is 215.95981 g/mol.
Where can I buy 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione?
You can request a quote for 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione?
Yes, CoreyChem provides custom synthesis services for 7,9-Dihydro-1H-purine-2,6,8(3H)-trithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.