![3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione structure](/static/products/3039/303969-75-7.webp)
3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione
TL;DR: 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione (CAS 303969-75-7) is a chemical compound with molecular formula C17H20N4O2S and molecular weight 344.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione
Also Known As: BAS 00964132, 3-methyl-7-(4-methylbenzyl)-8-(propylthio)xanthine, 3-methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione, 3-methyl-7-(4-methylbenzyl)-8-(propylthio)-1H-purine-2,6(3H,7H)-dione, 3-methyl-7-[(4-methylphenyl)methyl]-8-(propylsulfanyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C17H20N4O2S |
|---|---|
| Molecular Weight | 344.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 92.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.1307 |
| Heavy Atoms | 24 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 303969-75-7 |
|---|---|
| SMILES | CCCSC1=NC2=C(N1CC3=CC=C(C=C3)C)C(=O)NC(=O)N2C |
| InChIKey | ZIFJANJDTVNQRJ-UHFFFAOYSA-N |
Product Overview
3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione (CAS 303969-75-7), with molecular formula C17H20N4O2S and molecular weight 344.13 g/mol. IUPAC: 3-methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione.
Chemical Property Profile of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione
Property Insights of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione
The XLogP value of 3.1 indicates that 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione. Following Lipinski's Rule of Five, 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione has 1 hydrogen bond donor(s) and 4 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 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione?
The CAS number of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione is 303969-75-7.
What is the molecular formula of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione?
The molecular formula of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione is C17H20N4O2S.
What is the molecular weight of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione?
The molecular weight of 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione is 344.13 g/mol.
Where can I buy 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione?
You can request a quote for 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-7-[(4-methylphenyl)methyl]-8-propylsulfanylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.