Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate
TL;DR: Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate (CAS 21208-80-0) is a chemical compound with molecular formula C13H21NO4S2 and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-4-[4-(2-sulfosulfanylethylamino)butyl]benzene
Also Known As: 1-methoxy-4-[4-(2-sulfosulfanylethylamino)butyl]benzene, S-2-((4-(p-Methoxyphenyl)butyl)amino)ethyl hydrogen thiosulfate, 2-[4-(p-Methoxyphenyl)butylamino]ethanethiol sulfate, Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate, s-(2-{[4-(4-methoxyphenyl)butyl]amino}ethyl) hydrogen sulfurothioate
| Molecular Formula | C13H21NO4S2 |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 319.0912 |
| Heavy Atoms | 20 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 21208-80-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CCCCNCCSS(=O)(=O)O |
| InChIKey | GVAQGXFHYGHMRN-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate (CAS 21208-80-0), with molecular formula C13H21NO4S2 and molecular weight 319.09 g/mol. IUPAC: 1-methoxy-4-[4-(2-sulfosulfanylethylamino)butyl]benzene.
Chemical Property Profile of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate
Property Insights of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate
The XLogP value of -0.5 indicates that Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate. Following Lipinski's Rule of Five, Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate has 2 hydrogen bond donor(s) and 6 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-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate?
The CAS number of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate is 21208-80-0.
What is the molecular formula of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate?
The molecular formula of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate is C13H21NO4S2.
What is the molecular weight of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate?
The molecular weight of Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate is 319.09 g/mol.
Where can I buy Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate?
You can request a quote for Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-(4-(p-methoxyphenyl)butyl)amino-, hydrogen thiosulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.