![7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione structure](/static/products/3271/327167-96-4.webp)
7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione
TL;DR: 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione (CAS 327167-96-4) is a chemical compound with molecular formula C24H34N4O4S and molecular weight 474.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione
Also Known As: BAS 00458089, 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione, 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-(heptylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione, 7-(3-(4-ethylphenoxy)-2-hydroxypropyl)-8-(heptylthio)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-(heptylsulfanyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C24H34N4O4S |
|---|---|
| Molecular Weight | 474.23 g/mol |
| LogP | 3.4881 |
| Topological Polar Surface Area | 102.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 474.23007 |
| Heavy Atoms | 33 |
| Complexity | 1150.211 |
Chemical Identifiers
| CAS Number | 327167-96-4 |
|---|---|
| SMILES | CCCCCCCSC1=NC2=C(N1CC(COC3=CC=C(C=C3)CC)O)C(=O)NC(=O)N2C |
Product Overview
7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione (CAS 327167-96-4), with molecular formula C24H34N4O4S and molecular weight 474.23 g/mol. IUPAC: 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione.
Chemical Property Profile of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione
Property Insights of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione
The XLogP value of 3.4881 indicates that 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione. Following Lipinski's Rule of Five, 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione has 2 hydrogen bond donor(s) and 6 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 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione?
The CAS number of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione is 327167-96-4.
What is the molecular formula of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione?
The molecular formula of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione is C24H34N4O4S.
What is the molecular weight of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione?
The molecular weight of 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione is 474.23 g/mol.
Where can I buy 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione?
You can request a quote for 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-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 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-8-heptylsulfanyl-3-methylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.