2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate
TL;DR: 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate (CAS 565208-97-1) is a chemical compound with molecular formula C15H14BrNO3S and molecular weight 366.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenoxy)ethyl 2-methylsulfanylpyridine-3-carboxylate
Also Known As: 2-(4-bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate, 2-(4-bromophenoxy)ethyl 2-methylsulfanylpyridine-3-carboxylate
| Molecular Formula | C15H14BrNO3S |
|---|---|
| Molecular Weight | 366.99 g/mol |
| LogP | 3.8018 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.9878 |
| Heavy Atoms | 21 |
| Complexity | 604.1227 |
Chemical Identifiers
| CAS Number | 565208-97-1 |
|---|---|
| SMILES | CSC1=C(C=CC=N1)C(=O)OCCOC2=CC=C(C=C2)Br |
Product Overview
2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate (CAS 565208-97-1), with molecular formula C15H14BrNO3S and molecular weight 366.99 g/mol. IUPAC: 2-(4-bromophenoxy)ethyl 2-methylsulfanylpyridine-3-carboxylate.
Chemical Property Profile of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate
Property Insights of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate
The XLogP value of 3.8018 indicates that 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate 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 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate?
The CAS number of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate is 565208-97-1.
What is the molecular formula of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate?
The molecular formula of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate is C15H14BrNO3S.
What is the molecular weight of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate?
The molecular weight of 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate is 366.99 g/mol.
Where can I buy 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate?
You can request a quote for 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromophenoxy)ethyl 2-(methylsulfanyl)pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.