1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-
TL;DR: 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- (CAS 77456-45-2) is a chemical compound with molecular formula C15H16N4O2S and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[4-methoxy-2-(2-methylsulfanylethoxy)phenyl]-7H-purine
Also Known As: 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-, 8-(4-Methoxy-2-(2-(methylthio)ethoxy)phenyl)-1H-purine, 8-(4-Methoxy-2-(2-methylmercapto-aethoxy)-phenyl)-purin, 8-(4-Methoxy-2-(2-methylmercapto-aethoxy)-phenyl)-purin [German], 8-[4-methoxy-2-(2-methylmercapto-ethoxy)phenyl]purine
| Molecular Formula | C15H16N4O2S |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 2.7703 |
| Topological Polar Surface Area | 72.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.0994 |
| Heavy Atoms | 22 |
| Complexity | 742.07837 |
Chemical Identifiers
| CAS Number | 77456-45-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=NC3=NC=NC=C3N2)OCCSC |
Product Overview
1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- (CAS 77456-45-2), with molecular formula C15H16N4O2S and molecular weight 316.10 g/mol. IUPAC: 8-[4-methoxy-2-(2-methylsulfanylethoxy)phenyl]-7H-purine.
Chemical Property Profile of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-
Property Insights of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-
The XLogP value of 2.7703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-. The TPSA of 72.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-. Following Lipinski's Rule of Five, 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- has 1 hydrogen bond donor(s) and 6 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 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-?
The CAS number of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- is 77456-45-2.
What is the molecular formula of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-?
The molecular formula of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- is C15H16N4O2S.
What is the molecular weight of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-?
The molecular weight of 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- is 316.10 g/mol.
Where can I buy 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-?
You can request a quote for 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine, 8-(4-methoxy-2-(2-(methylthio)ethoxy)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.