2-methyl-6-methylsulfanyl-7H-purine
TL;DR: 2-methyl-6-methylsulfanyl-7H-purine (CAS 1008-47-5) 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.
2-methyl-6-methylsulfanyl-7H-purine
Also Known As: 2-methyl-6-methylsulfanyl-7H-purine, 2-Methyl-6-(methylthio)-1H-purine, 2-Methyl-6-methylthiopurine, Purine, 2-methyl-6-(methylthio)-, 1H-Purine, 2-methyl-6-(methylthio)-
| Molecular Formula | C7H8N4S |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.04697 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 1008-47-5 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)SC)NC=N2 |
| InChIKey | BXIODMKZAUYUKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-methyl-6-methylsulfanyl-7H-purine (CAS 1008-47-5), with molecular formula C7H8N4S and molecular weight 180.05 g/mol. IUPAC: 2-methyl-6-methylsulfanyl-7H-purine.
Chemical Property Profile of 2-methyl-6-methylsulfanyl-7H-purine
Property Insights of 2-methyl-6-methylsulfanyl-7H-purine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-6-methylsulfanyl-7H-purine. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-6-methylsulfanyl-7H-purine. Following Lipinski's Rule of Five, 2-methyl-6-methylsulfanyl-7H-purine has 1 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 2-methyl-6-methylsulfanyl-7H-purine?
The CAS number of 2-methyl-6-methylsulfanyl-7H-purine is 1008-47-5.
What is the molecular formula of 2-methyl-6-methylsulfanyl-7H-purine?
The molecular formula of 2-methyl-6-methylsulfanyl-7H-purine is C7H8N4S.
What is the molecular weight of 2-methyl-6-methylsulfanyl-7H-purine?
The molecular weight of 2-methyl-6-methylsulfanyl-7H-purine is 180.05 g/mol.
Where can I buy 2-methyl-6-methylsulfanyl-7H-purine?
You can request a quote for 2-methyl-6-methylsulfanyl-7H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-6-methylsulfanyl-7H-purine?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-6-methylsulfanyl-7H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.