![2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine structure](/static/products/3392/339276-16-3.webp)
2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine
TL;DR: 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine (CAS 339276-16-3) is a chemical compound with molecular formula C18H13Cl2FN2O2S and molecular weight 410.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine
Also Known As: 4J-675S, 2-[(3,4-dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine, 2-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine, 2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-fluorophenoxy)-5-methoxypyrimidine
| Molecular Formula | C18H13Cl2FN2O2S |
|---|---|
| Molecular Weight | 410.01 g/mol |
| LogP | 6.0157 |
| Topological Polar Surface Area | 44.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.0059 |
| Heavy Atoms | 26 |
| Complexity | 910.193 |
Chemical Identifiers
| CAS Number | 339276-16-3 |
|---|---|
| SMILES | COC1=CN=C(N=C1OC2=CC=C(C=C2)F)SCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine (CAS 339276-16-3), with molecular formula C18H13Cl2FN2O2S and molecular weight 410.01 g/mol. IUPAC: 2-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine.
Chemical Property Profile of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine
Property Insights of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine
The XLogP value of 6.0157 indicates that 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.24 Ų, 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine?
The CAS number of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine is 339276-16-3.
What is the molecular formula of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine?
The molecular formula of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine is C18H13Cl2FN2O2S.
What is the molecular weight of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine?
The molecular weight of 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine is 410.01 g/mol.
Where can I buy 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine?
You can request a quote for 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3,4-Dichlorobenzyl)sulfanyl]-4-(4-fluorophenoxy)-5-methoxypyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.