![4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether structure](/static/products/4782/478258-40-1.webp)
4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether
TL;DR: 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether (CAS 478258-40-1) is a chemical compound with molecular formula C12H11ClN2OS2 and molecular weight 298.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-6-(4-methoxyphenyl)sulfanyl-2-methylsulfanylpyrimidine
Also Known As: 8P-816, 4-chloro-6-(4-methoxyphenyl)sulfanyl-2-methylsulfanylpyrimidine, 4-{[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether, 4-chloro-6-[(4-methoxyphenyl)sulfanyl]-2-(methylsulfanyl)pyrimidine
| Molecular Formula | C12H11ClN2OS2 |
|---|---|
| Molecular Weight | 298.00 g/mol |
| LogP | 4.0117 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.00012 |
| Heavy Atoms | 18 |
| Complexity | 534.10065 |
Chemical Identifiers
| CAS Number | 478258-40-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SC2=CC(=NC(=N2)SC)Cl |
Product Overview
4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether (CAS 478258-40-1), with molecular formula C12H11ClN2OS2 and molecular weight 298.00 g/mol. IUPAC: 4-chloro-6-(4-methoxyphenyl)sulfanyl-2-methylsulfanylpyrimidine.
Chemical Property Profile of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether
Property Insights of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether
The XLogP value of 4.0117 indicates that 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether 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-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether has 0 hydrogen bond donor(s) and 5 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-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether?
The CAS number of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether is 478258-40-1.
What is the molecular formula of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether?
The molecular formula of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether is C12H11ClN2OS2.
What is the molecular weight of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether?
The molecular weight of 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether is 298.00 g/mol.
Where can I buy 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether?
You can request a quote for 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether?
Yes, KEHONG BIO provides custom synthesis services for 4-{[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]sulfanyl}phenyl methyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.