6-(4-methoxyphenyl)sulfanyl-7H-purine
TL;DR: 6-(4-methoxyphenyl)sulfanyl-7H-purine (CAS 646510-08-9) is a chemical compound with molecular formula C12H10N4OS and molecular weight 258.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)sulfanyl-7H-purine
Also Known As: 6-(4-methoxyphenyl)sulfanyl-7H-purine, 6-(4-Methoxybenzenethio)purine, 6-((4-Methoxyphenyl)thio)-1H-purine, 6-(4-methoxyphenyl)sulfanyl-9H-purine, 1H-Purine, 6-[(4-methoxyphenyl)thio]-
| Molecular Formula | C12H10N4OS |
|---|---|
| Molecular Weight | 258.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 89.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.05753 |
| Heavy Atoms | 18 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 646510-08-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SC2=NC=NC3=C2NC=N3 |
| InChIKey | JMGCYSLZRQCADR-UHFFFAOYSA-N |
Product Overview
6-(4-methoxyphenyl)sulfanyl-7H-purine (CAS 646510-08-9), with molecular formula C12H10N4OS and molecular weight 258.06 g/mol. IUPAC: 6-(4-methoxyphenyl)sulfanyl-7H-purine.
Chemical Property Profile of 6-(4-methoxyphenyl)sulfanyl-7H-purine
Property Insights of 6-(4-methoxyphenyl)sulfanyl-7H-purine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(4-methoxyphenyl)sulfanyl-7H-purine. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(4-methoxyphenyl)sulfanyl-7H-purine. Following Lipinski's Rule of Five, 6-(4-methoxyphenyl)sulfanyl-7H-purine 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 6-(4-methoxyphenyl)sulfanyl-7H-purine?
The CAS number of 6-(4-methoxyphenyl)sulfanyl-7H-purine is 646510-08-9.
What is the molecular formula of 6-(4-methoxyphenyl)sulfanyl-7H-purine?
The molecular formula of 6-(4-methoxyphenyl)sulfanyl-7H-purine is C12H10N4OS.
What is the molecular weight of 6-(4-methoxyphenyl)sulfanyl-7H-purine?
The molecular weight of 6-(4-methoxyphenyl)sulfanyl-7H-purine is 258.06 g/mol.
Where can I buy 6-(4-methoxyphenyl)sulfanyl-7H-purine?
You can request a quote for 6-(4-methoxyphenyl)sulfanyl-7H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(4-methoxyphenyl)sulfanyl-7H-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-methoxyphenyl)sulfanyl-7H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.