4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether
TL;DR: 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether (CAS 723248-93-9) is a chemical compound with molecular formula C13H13BrN2OS and molecular weight 323.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-bromo-2-methylphenoxy)ethylsulfanyl]pyrimidine
Also Known As: 4-bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether, 2-[2-(4-bromo-2-methylphenoxy)ethylsulfanyl]pyrimidine, AJ-292/42547003
| Molecular Formula | C13H13BrN2OS |
|---|---|
| Molecular Weight | 323.99 g/mol |
| LogP | 3.71862 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.9932 |
| Heavy Atoms | 18 |
| Complexity | 507.59937 |
Chemical Identifiers
| CAS Number | 723248-93-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Br)OCCSC2=NC=CC=N2 |
Product Overview
4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether (CAS 723248-93-9), with molecular formula C13H13BrN2OS and molecular weight 323.99 g/mol. IUPAC: 2-[2-(4-bromo-2-methylphenoxy)ethylsulfanyl]pyrimidine.
Chemical Property Profile of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether
Property Insights of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether
The XLogP value of 3.71862 indicates that 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl 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-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether 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-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether?
The CAS number of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether is 723248-93-9.
What is the molecular formula of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether?
The molecular formula of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether is C13H13BrN2OS.
What is the molecular weight of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether?
The molecular weight of 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether is 323.99 g/mol.
Where can I buy 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether?
You can request a quote for 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-methylphenyl 2-(2-pyrimidinylsulfanyl)ethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.