Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)
TL;DR: Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) (CAS 53716-45-3) is a chemical compound with molecular formula C9H13ClN2O4S2 and molecular weight 312.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-[2-(2-sulfosulfanylethylamino)ethoxy]pyridine
Also Known As: 5-iodo-3H-isobenzofuran-1-one, S-2-((2-(5-Chloro-2-pyridyloxy)ethyl)amino)ethyl hydrogen thiosulfate, Ethanethiosulfuric acid, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, s-[2-({2-[(5-chloropyridin-2-yl)oxy]ethyl}amino)ethyl] hydrogen sulfurothioate, Thiosulfuric acid, S-(2-((2-(5-chloro-2-pyridyloxy)ethyl)amino)ethyl) ester
| Molecular Formula | C9H13ClN2O4S2 |
|---|---|
| Molecular Weight | 312.00 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.00052 |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 53716-45-3 |
|---|---|
| SMILES | C1=CC(=NC=C1Cl)OCCNCCSS(=O)(=O)O |
| InChIKey | TWIULPUWWRMHGV-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) (CAS 53716-45-3), with molecular formula C9H13ClN2O4S2 and molecular weight 312.00 g/mol. IUPAC: 5-chloro-2-[2-(2-sulfosulfanylethylamino)ethoxy]pyridine.
Chemical Property Profile of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)
Property Insights of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)
The XLogP value of -1.6 indicates that Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester). Following Lipinski's Rule of Five, Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) has 2 hydrogen bond donor(s) and 7 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 Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)?
The CAS number of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) is 53716-45-3.
What is the molecular formula of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)?
The molecular formula of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) is C9H13ClN2O4S2.
What is the molecular weight of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)?
The molecular weight of Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) is 312.00 g/mol.
Where can I buy Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)?
You can request a quote for Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-(2-(5-chloro-2-pyridyloxy)ethyl)amino-, hydrogen sulfate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.