![3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione structure](/static/products/6742/674296-86-7.webp)
3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione
TL;DR: 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione (CAS 674296-86-7) is a chemical compound with molecular formula C20H18N4O2S and molecular weight 378.12 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-phenylsulfanylpurine-2,6-dione
Also Known As: AB01295777-01, 3-methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione, 3-methyl-7-[(4-methylphenyl)methyl]-8-phenylthio-1,3,7-trihydropurine-2,6-dion e, 3-methyl-7-[(4-methylphenyl)methyl]-8-(phenylsulfanyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C20H18N4O2S |
|---|---|
| Molecular Weight | 378.12 g/mol |
| LogP | 2.93122 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.11505 |
| Heavy Atoms | 27 |
| Complexity | 1221.3046 |
Chemical Identifiers
| CAS Number | 674296-86-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=C(N=C2SC4=CC=CC=C4)N(C(=O)NC3=O)C |
Product Overview
3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione (CAS 674296-86-7), with molecular formula C20H18N4O2S and molecular weight 378.12 g/mol. IUPAC: 3-methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione.
Chemical Property Profile of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione
Property Insights of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione
The XLogP value of 2.93122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione. Following Lipinski's Rule of Five, 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-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-phenylsulfanylpurine-2,6-dione?
The CAS number of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione is 674296-86-7.
What is the molecular formula of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione?
The molecular formula of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione is C20H18N4O2S.
What is the molecular weight of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione?
The molecular weight of 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione is 378.12 g/mol.
Where can I buy 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione?
You can request a quote for 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-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-phenylsulfanylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-7-[(4-methylphenyl)methyl]-8-phenylsulfanylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.