4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine
TL;DR: 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine (CAS 339346-63-3) is a chemical compound with molecular formula C15H16Cl2N2OS and molecular weight 342.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-5-[(4-ethoxy-3-methylphenyl)methyl]-2-methylsulfanylpyrimidine
Also Known As: 4,6-dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylthio)pyrimidine, 4,6-dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine, 4,6-dichloro-5-[(4-ethoxy-3-methylphenyl)methyl]-2-methylsulfanylpyrimidine
| Molecular Formula | C15H16Cl2N2OS |
|---|---|
| Molecular Weight | 342.04 g/mol |
| LogP | 4.80322 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.03604 |
| Heavy Atoms | 21 |
| Complexity | 626.56104 |
Chemical Identifiers
| CAS Number | 339346-63-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CC2=C(N=C(N=C2Cl)SC)Cl)C |
Product Overview
4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine (CAS 339346-63-3), with molecular formula C15H16Cl2N2OS and molecular weight 342.04 g/mol. IUPAC: 4,6-dichloro-5-[(4-ethoxy-3-methylphenyl)methyl]-2-methylsulfanylpyrimidine.
Chemical Property Profile of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine
Property Insights of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine
The XLogP value of 4.80322 indicates that 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.01 Ų, 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine has 0 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 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine?
The CAS number of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine is 339346-63-3.
What is the molecular formula of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine?
The molecular formula of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine is C15H16Cl2N2OS.
What is the molecular weight of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine?
The molecular weight of 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine is 342.04 g/mol.
Where can I buy 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine?
You can request a quote for 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-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 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dichloro-5-(4-ethoxy-3-methylbenzyl)-2-(methylsulfanyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.