8-Phenyl-3,7-dihydropurine-6-thione
TL;DR: 8-Phenyl-3,7-dihydropurine-6-thione (CAS 3298-76-8) is a chemical compound with molecular formula C11H8N4S and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-phenyl-3,7-dihydropurine-6-thione
Also Known As: 8-phenyl-6-thiopurine, 8-phenyl-3,7-dihydropurine-6-thione, 8-phenyl-6-mercaptopurine, 8-Phenyl-9H-purine-6-thiol, 8-phenyl-1H-purine-6(7H)-thione
| Molecular Formula | C11H8N4S |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 2.68249 |
| Topological Polar Surface Area | 57.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.04697 |
| Heavy Atoms | 16 |
| Complexity | 683.776 |
Chemical Identifiers
| CAS Number | 3298-76-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=C(N2)C(=S)N=CN3 |
Product Overview
8-Phenyl-3,7-dihydropurine-6-thione (CAS 3298-76-8), with molecular formula C11H8N4S and molecular weight 228.05 g/mol. IUPAC: 8-phenyl-3,7-dihydropurine-6-thione.
Chemical Property Profile of 8-Phenyl-3,7-dihydropurine-6-thione
Property Insights of 8-Phenyl-3,7-dihydropurine-6-thione
The XLogP value of 2.68249 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Phenyl-3,7-dihydropurine-6-thione. With a topological polar surface area (TPSA) of 57.36 Ų, 8-Phenyl-3,7-dihydropurine-6-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Phenyl-3,7-dihydropurine-6-thione has 2 hydrogen bond donor(s) and 3 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 8-Phenyl-3,7-dihydropurine-6-thione?
The CAS number of 8-Phenyl-3,7-dihydropurine-6-thione is 3298-76-8.
What is the molecular formula of 8-Phenyl-3,7-dihydropurine-6-thione?
The molecular formula of 8-Phenyl-3,7-dihydropurine-6-thione is C11H8N4S.
What is the molecular weight of 8-Phenyl-3,7-dihydropurine-6-thione?
The molecular weight of 8-Phenyl-3,7-dihydropurine-6-thione is 228.05 g/mol.
Where can I buy 8-Phenyl-3,7-dihydropurine-6-thione?
You can request a quote for 8-Phenyl-3,7-dihydropurine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Phenyl-3,7-dihydropurine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 8-Phenyl-3,7-dihydropurine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.