![6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine structure](/static/products/2013/20133-65-7.webp)
6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine
TL;DR: 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine (CAS 20133-65-7) is a chemical compound with molecular formula C18H13FN4S and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-fluorophenyl)methylsulfanyl]-9-phenylpurine
Also Known As: 6-[(4-fluorobenzyl)sulfanyl]-9-phenyl-9h-purine, 6-((4-Fluorobenzyl)thio)-9-phenyl-9H-purine, 6-[(4-fluorophenyl)methylsulfanyl]-9-phenylpurine, 9H-Purine,6-[[(4-fluorophenyl)methyl]thio]-9-phenyl-, 6-{[(4-Fluorophenyl)methyl]sulfanyl}-9-phenyl-9H-purine
| Molecular Formula | C18H13FN4S |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.0845 |
| Heavy Atoms | 24 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 20133-65-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=NC3=C2N=CN=C3SCC4=CC=C(C=C4)F |
| InChIKey | ZFWKNFDJDPXHBD-UHFFFAOYSA-N |
Product Overview
6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine (CAS 20133-65-7), with molecular formula C18H13FN4S and molecular weight 336.08 g/mol. IUPAC: 6-[(4-fluorophenyl)methylsulfanyl]-9-phenylpurine.
Chemical Property Profile of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine
Property Insights of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine
The XLogP value of 4.2 indicates that 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine. Following Lipinski's Rule of Five, 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine has 0 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-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine?
The CAS number of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine is 20133-65-7.
What is the molecular formula of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine?
The molecular formula of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine is C18H13FN4S.
What is the molecular weight of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine?
The molecular weight of 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine is 336.08 g/mol.
Where can I buy 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine?
You can request a quote for 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-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-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-Fluorobenzyl)sulfanyl]-9-phenyl-9h-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.