8-Methyl-6-thiopurine
TL;DR: 8-Methyl-6-thiopurine (CAS 1126-23-4) is a chemical compound with molecular formula C6H6N4S and molecular weight 166.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methyl-3,7-dihydropurine-6-thione
Also Known As: 8-Methyl-6-thiopurine, 8-Methyl-6-thioxopurine, Purine-6(1H)-thione, 8-methyl-, 8-Methyl-9H-purine-6-thiol, 8-methyl-3,7-dihydropurine-6-thione
| Molecular Formula | C6H6N4S |
|---|---|
| Molecular Weight | 166.03 g/mol |
| LogP | 1.32391 |
| Topological Polar Surface Area | 57.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.03131 |
| Heavy Atoms | 11 |
| Complexity | 441.02417 |
Chemical Identifiers
| CAS Number | 1126-23-4 |
|---|---|
| SMILES | CC1=NC2=C(N1)C(=S)N=CN2 |
Product Overview
8-Methyl-6-thiopurine (CAS 1126-23-4), with molecular formula C6H6N4S and molecular weight 166.03 g/mol. IUPAC: 8-methyl-3,7-dihydropurine-6-thione.
Chemical Property Profile of 8-Methyl-6-thiopurine
Property Insights of 8-Methyl-6-thiopurine
The XLogP value of 1.32391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Methyl-6-thiopurine. With a topological polar surface area (TPSA) of 57.36 Ų, 8-Methyl-6-thiopurine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Methyl-6-thiopurine 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 8-Methyl-6-thiopurine?
The CAS number of 8-Methyl-6-thiopurine is 1126-23-4.
What is the molecular formula of 8-Methyl-6-thiopurine?
The molecular formula of 8-Methyl-6-thiopurine is C6H6N4S.
What is the molecular weight of 8-Methyl-6-thiopurine?
The molecular weight of 8-Methyl-6-thiopurine is 166.03 g/mol.
Where can I buy 8-Methyl-6-thiopurine?
You can request a quote for 8-Methyl-6-thiopurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Methyl-6-thiopurine?
Yes, KEHONG BIO provides custom synthesis services for 8-Methyl-6-thiopurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.