Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)
TL;DR: Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) (CAS 24203-77-8) is a chemical compound with molecular formula C14H23NO4S2 and molecular weight 333.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-3-[4-(2-sulfosulfanylethylamino)butoxy]benzene
Also Known As: S-2-((4-(2,3-Xylyloxy)butyl)amino)ethyl thiosulfate, 2-[4-(2,3-xylyloxy)butyl]aminoethanethiol sulfate, Thiosulfuric acid, S-(2-((4-(2,3-xylyl)butyl)amino)ethyl) ester, 2-((4-(2,3-Xylyloxy)butyl)amino)ethanethiol hydrogen sulfate (ester), Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)
| Molecular Formula | C14H23NO4S2 |
|---|---|
| Molecular Weight | 333.11 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 333.10684 |
| Heavy Atoms | 21 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 24203-77-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)OCCCCNCCSS(=O)(=O)O)C |
| InChIKey | MPDLYBOYKQTXQZ-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) (CAS 24203-77-8), with molecular formula C14H23NO4S2 and molecular weight 333.11 g/mol. IUPAC: 1,2-dimethyl-3-[4-(2-sulfosulfanylethylamino)butoxy]benzene.
Chemical Property Profile of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)
Property Insights of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester). The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester). Following Lipinski's Rule of Five, Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) 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-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)?
The CAS number of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) is 24203-77-8.
What is the molecular formula of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)?
The molecular formula of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) is C14H23NO4S2.
What is the molecular weight of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)?
The molecular weight of Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) is 333.11 g/mol.
Where can I buy Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)?
You can request a quote for Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)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-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-(4-(2,3-xylyloxy)butyl)amino-, hydrogen sulfate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.