6-phenethylsulfanyl-7H-purin-2-amine
TL;DR: 6-phenethylsulfanyl-7H-purin-2-amine (CAS 92025-69-9) is a chemical compound with molecular formula C13H13N5S and molecular weight 271.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-phenylethylsulfanyl)-7H-purin-2-amine
Also Known As: 6-phenethylsulfanyl-7H-purin-2-amine, NCIStruc1_000418, NCIStruc2_000499, 6-(Phenethylthio)-7H-purin-2-amine, AU 135
| Molecular Formula | C13H13N5S |
|---|---|
| Molecular Weight | 271.09 g/mol |
| LogP | 2.2699 |
| Topological Polar Surface Area | 80.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.08917 |
| Heavy Atoms | 19 |
| Complexity | 679.8212 |
Chemical Identifiers
| CAS Number | 92025-69-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCSC2=NC(=NC3=C2NC=N3)N |
Product Overview
6-phenethylsulfanyl-7H-purin-2-amine (CAS 92025-69-9), with molecular formula C13H13N5S and molecular weight 271.09 g/mol. IUPAC: 6-(2-phenylethylsulfanyl)-7H-purin-2-amine.
Chemical Property Profile of 6-phenethylsulfanyl-7H-purin-2-amine
Property Insights of 6-phenethylsulfanyl-7H-purin-2-amine
The XLogP value of 2.2699 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-phenethylsulfanyl-7H-purin-2-amine. The TPSA of 80.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-phenethylsulfanyl-7H-purin-2-amine. Following Lipinski's Rule of Five, 6-phenethylsulfanyl-7H-purin-2-amine has 2 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-phenethylsulfanyl-7H-purin-2-amine?
The CAS number of 6-phenethylsulfanyl-7H-purin-2-amine is 92025-69-9.
What is the molecular formula of 6-phenethylsulfanyl-7H-purin-2-amine?
The molecular formula of 6-phenethylsulfanyl-7H-purin-2-amine is C13H13N5S.
What is the molecular weight of 6-phenethylsulfanyl-7H-purin-2-amine?
The molecular weight of 6-phenethylsulfanyl-7H-purin-2-amine is 271.09 g/mol.
Where can I buy 6-phenethylsulfanyl-7H-purin-2-amine?
You can request a quote for 6-phenethylsulfanyl-7H-purin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-phenethylsulfanyl-7H-purin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-phenethylsulfanyl-7H-purin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.