![6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine structure](/static/products/5069/5069-79-4.webp)
6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine
TL;DR: 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine (CAS 5069-79-4) 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-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine
Also Known As: 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine, 6-((4-methylbenzyl)thio)-7H-purin-2-amine, 6-[(4-Methylbenzyl)thio]-9H-purin-2-amine, 2-amino-6- [(4-methylphenyl)methylthio]purine, 6-{[(4-Methylphenyl)methyl]sulfanyl}-7H-purin-2-amine
| Molecular Formula | C13H13N5S |
|---|---|
| Molecular Weight | 271.09 g/mol |
| LogP | 2.53582 |
| Topological Polar Surface Area | 80.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.08917 |
| Heavy Atoms | 19 |
| Complexity | 704.6304 |
Chemical Identifiers
| CAS Number | 5069-79-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=NC(=NC3=C2NC=N3)N |
Product Overview
6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine (CAS 5069-79-4), with molecular formula C13H13N5S and molecular weight 271.09 g/mol. IUPAC: 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine.
Chemical Property Profile of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine
Property Insights of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine
The XLogP value of 2.53582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine. The TPSA of 80.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine. Following Lipinski's Rule of Five, 6-[(4-methylphenyl)methylsulfanyl]-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-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine?
The CAS number of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine is 5069-79-4.
What is the molecular formula of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine?
The molecular formula of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine is C13H13N5S.
What is the molecular weight of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine?
The molecular weight of 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine is 271.09 g/mol.
Where can I buy 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine?
You can request a quote for 6-[(4-methylphenyl)methylsulfanyl]-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-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-methylphenyl)methylsulfanyl]-7H-purin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.