7-methylpurine-2,6-dithione
TL;DR: 7-methylpurine-2,6-dithione (CAS 33403-02-0) is a chemical compound with molecular formula C6H6N4S2 and molecular weight 198.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3H-purine-2,6-dithione
Also Known As: 7-methylpurine-2,6-dithione, 2,6-dithio-7-methylpurine, 7-methyl-3H-purine-2,6-dithione, 1H-Purine-2,6-dithione, 3,7-dihydro-7-methyl-, J2.558.051F
| Molecular Formula | C6H6N4S2 |
|---|---|
| Molecular Weight | 198.00 g/mol |
| LogP | 1.68848 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.00339 |
| Heavy Atoms | 12 |
| Complexity | 532.20703 |
Chemical Identifiers
| CAS Number | 33403-02-0 |
|---|---|
| SMILES | CN1C=NC2=C1C(=S)NC(=S)N2 |
Product Overview
7-methylpurine-2,6-dithione (CAS 33403-02-0), with molecular formula C6H6N4S2 and molecular weight 198.00 g/mol. IUPAC: 7-methyl-3H-purine-2,6-dithione.
Chemical Property Profile of 7-methylpurine-2,6-dithione
Property Insights of 7-methylpurine-2,6-dithione
The XLogP value of 1.68848 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-methylpurine-2,6-dithione. With a topological polar surface area (TPSA) of 49.4 Ų, 7-methylpurine-2,6-dithione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methylpurine-2,6-dithione has 2 hydrogen bond donor(s) and 3 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 7-methylpurine-2,6-dithione?
The CAS number of 7-methylpurine-2,6-dithione is 33403-02-0.
What is the molecular formula of 7-methylpurine-2,6-dithione?
The molecular formula of 7-methylpurine-2,6-dithione is C6H6N4S2.
What is the molecular weight of 7-methylpurine-2,6-dithione?
The molecular weight of 7-methylpurine-2,6-dithione is 198.00 g/mol.
Where can I buy 7-methylpurine-2,6-dithione?
You can request a quote for 7-methylpurine-2,6-dithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-methylpurine-2,6-dithione?
Yes, KEHONG BIO provides custom synthesis services for 7-methylpurine-2,6-dithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.