4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine
TL;DR: 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine (CAS 339017-86-6) is a chemical compound with molecular formula C24H28N4OS2 and molecular weight 452.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-ethoxyphenyl)piperazin-1-yl]-6-(4-methylphenyl)sulfanyl-2-methylsulfanylpyrimidine
Also Known As: 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine, 4-[4-(2-Ethoxyphenyl)-1-piperazinyl]-6-[(4-methylphenyl)thio]-2-(methylthio)pyrimidine, 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-6-(4-methylphenyl)sulfanyl-2-methylsulfanyl-pyrimidine, 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-6-(4-methylphenyl)sulfanyl-2-methylsulfanylpyrimidine, 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-6-[(4-methylphenyl)sulfanyl]-2-(methylsulfanyl)pyrimidine
| Molecular Formula | C24H28N4OS2 |
|---|---|
| Molecular Weight | 452.17 g/mol |
| LogP | 5.38342 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.17044 |
| Heavy Atoms | 31 |
| Complexity | 1004.71606 |
Chemical Identifiers
| CAS Number | 339017-86-6 |
|---|---|
| SMILES | CCOC1=CC=CC=C1N2CCN(CC2)C3=CC(=NC(=N3)SC)SC4=CC=C(C=C4)C |
Product Overview
4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine (CAS 339017-86-6), with molecular formula C24H28N4OS2 and molecular weight 452.17 g/mol. IUPAC: 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-6-(4-methylphenyl)sulfanyl-2-methylsulfanylpyrimidine.
Chemical Property Profile of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine
Property Insights of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine
The XLogP value of 5.38342 indicates that 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine?
The CAS number of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine is 339017-86-6.
What is the molecular formula of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine?
The molecular formula of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine is C24H28N4OS2.
What is the molecular weight of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine?
The molecular weight of 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine is 452.17 g/mol.
Where can I buy 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine?
You can request a quote for 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(2-Ethoxyphenyl)piperazino)-6-((4-methylphenyl)sulfanyl)-2-(methylsulfanyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.