1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-
TL;DR: 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- (CAS 77456-53-2) is a chemical compound with molecular formula C13H12N4O2S and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-methoxy-4-methylsulfinylphenyl)-7H-purine
Also Known As: 8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine, ISOMAZOLE,PYRIMIDYL ANALOG, 8-(2-methoxy-4-methylsulfinylphenyl)-7H-purine, 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-, 8-(2-Methoxy-4-methylsulfinyl-phenyl)-purin
| Molecular Formula | C13H12N4O2S |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 1.7659 |
| Topological Polar Surface Area | 80.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.06808 |
| Heavy Atoms | 20 |
| Complexity | 766.9204 |
Chemical Identifiers
| CAS Number | 77456-53-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)S(=O)C)C2=NC3=NC=NC=C3N2 |
Product Overview
1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- (CAS 77456-53-2), with molecular formula C13H12N4O2S and molecular weight 288.07 g/mol. IUPAC: 8-(2-methoxy-4-methylsulfinylphenyl)-7H-purine.
Chemical Property Profile of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-
Property Insights of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-
The XLogP value of 1.7659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-. The TPSA of 80.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-. Following Lipinski's Rule of Five, 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- has 1 hydrogen bond donor(s) and 5 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-(2-methoxy-4-(methylsulfinyl)phenyl)-?
The CAS number of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- is 77456-53-2.
What is the molecular formula of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-?
The molecular formula of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- is C13H12N4O2S.
What is the molecular weight of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-?
The molecular weight of 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- is 288.07 g/mol.
Where can I buy 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-?
You can request a quote for 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)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-(2-methoxy-4-(methylsulfinyl)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.