3-Methyl-6-methylthiopurine
TL;DR: 3-Methyl-6-methylthiopurine (CAS 1092-33-7) is a chemical compound with molecular formula C7H8N4S and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-methylsulfanylpurine
Also Known As: 3-Methyl-6-methylthiopurine, 3-methyl-6-methylsulfanylpurine, 3-methyl-6-(methylthio)-3H-purine, 3-Methyl-6-methylthio-3H-purine, NCIOpen2_000230
| Molecular Formula | C7H8N4S |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.04697 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 1092-33-7 |
|---|---|
| SMILES | CN1C=NC(=C2C1=NC=N2)SC |
| InChIKey | JZJPPRVXJHAHQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-6-methylthiopurine (CAS 1092-33-7), with molecular formula C7H8N4S and molecular weight 180.05 g/mol. IUPAC: 3-methyl-6-methylsulfanylpurine.
Chemical Property Profile of 3-Methyl-6-methylthiopurine
Property Insights of 3-Methyl-6-methylthiopurine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-6-methylthiopurine. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-6-methylthiopurine. Following Lipinski's Rule of Five, 3-Methyl-6-methylthiopurine has 0 hydrogen bond donor(s) and 4 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 3-Methyl-6-methylthiopurine?
The CAS number of 3-Methyl-6-methylthiopurine is 1092-33-7.
What is the molecular formula of 3-Methyl-6-methylthiopurine?
The molecular formula of 3-Methyl-6-methylthiopurine is C7H8N4S.
What is the molecular weight of 3-Methyl-6-methylthiopurine?
The molecular weight of 3-Methyl-6-methylthiopurine is 180.05 g/mol.
Where can I buy 3-Methyl-6-methylthiopurine?
You can request a quote for 3-Methyl-6-methylthiopurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-6-methylthiopurine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-6-methylthiopurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.