1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane
TL;DR: 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane (CAS 64222-44-2) is a chemical compound with molecular formula C12H19NS and molecular weight 209.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethylsulfanylethyl)-4,5,6,7-tetrahydroindole
Also Known As: J2.589.012D, 1-(2-ethylsulfanylethyl)-4,5,6,7-tetrahydroindole, 1-(2-ethylsulfanyl-ethyl)-4,5,6,7-tetrahydro-indole, 1-ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane, 1-[2-(Ethylthio)ethyl]-4,5,6,7-tetrahydro-1H-indole
| Molecular Formula | C12H19NS |
|---|---|
| Molecular Weight | 209.12 g/mol |
| LogP | 3.12 |
| Topological Polar Surface Area | 4.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.12383 |
| Heavy Atoms | 14 |
| Complexity | 290.51187 |
Chemical Identifiers
| CAS Number | 64222-44-2 |
|---|---|
| SMILES | CCSCCN1C=CC2=C1CCCC2 |
Product Overview
1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane (CAS 64222-44-2), with molecular formula C12H19NS and molecular weight 209.12 g/mol. IUPAC: 1-(2-ethylsulfanylethyl)-4,5,6,7-tetrahydroindole.
Chemical Property Profile of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane
Property Insights of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane
The XLogP value of 3.12 indicates that 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.93 Ų, 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane has 0 hydrogen bond donor(s) and 1 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 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane?
The CAS number of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane is 64222-44-2.
What is the molecular formula of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane?
The molecular formula of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane is C12H19NS.
What is the molecular weight of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane?
The molecular weight of 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane is 209.12 g/mol.
Where can I buy 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane?
You can request a quote for 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylthio-2-(4,5,6,7-tetrahydroindolyl)ethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.