![4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine structure](/static/products/684/684235-55-0.png)
4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine
TL;DR: 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine (CAS 684235-55-0) is a chemical compound with molecular formula C13H14BrN3OS and molecular weight 339.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-bromophenoxy)ethylsulfanyl]-6-methylpyrimidin-2-amine
Also Known As: 4-{[2-(4-bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine, 4-[2-(4-bromophenoxy)ethylsulfanyl]-6-methylpyrimidin-2-amine, 4-{[2-(4-bromophenoxy)ethyl]sulfanyl}-6-methylpyrimidin-2-amine, 4-((2-(4-bromophenoxy)ethyl)thio)-6-methylpyrimidin-2-amine
| Molecular Formula | C13H14BrN3OS |
|---|---|
| Molecular Weight | 339.00 g/mol |
| LogP | 3.30082 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.0041 |
| Heavy Atoms | 19 |
| Complexity | 527.83466 |
Chemical Identifiers
| CAS Number | 684235-55-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N)SCCOC2=CC=C(C=C2)Br |
Product Overview
4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine (CAS 684235-55-0), with molecular formula C13H14BrN3OS and molecular weight 339.00 g/mol. IUPAC: 4-[2-(4-bromophenoxy)ethylsulfanyl]-6-methylpyrimidin-2-amine.
Chemical Property Profile of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine
Property Insights of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine
The XLogP value of 3.30082 indicates that 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine. Following Lipinski's Rule of Five, 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine has 1 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-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine?
The CAS number of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine is 684235-55-0.
What is the molecular formula of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine?
The molecular formula of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine is C13H14BrN3OS.
What is the molecular weight of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine?
The molecular weight of 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine is 339.00 g/mol.
Where can I buy 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine?
You can request a quote for 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 4-{[2-(4-Bromophenoxy)ethyl]thio}-6-methyl-2-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.