![[2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide structure](/static/products/3862/386229-80-7.webp)
[2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide
TL;DR: [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide (CAS 386229-80-7) is a chemical compound with molecular formula C12H20NO2S2+ and molecular weight 274.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-(4-methylphenyl)sulfonylsulfanylethyl]azanium
Also Known As: [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide|Trimethyl-[2-(4-methylphenyl)sulfonylsulfanylethyl]azanium|[2-(Trimethylammonium)ethyl]toluenethiosulfonate bromide
| Molecular Formula | C12H20NO2S2+ |
|---|---|
| Molecular Weight | 274.09 g/mol |
| LogP | 2.12312 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 274.09354 |
| Heavy Atoms | 17 |
| Complexity | 458.27414 |
Chemical Identifiers
| CAS Number | 386229-80-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)SCC[N+](C)(C)C |
Product Overview
[2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide (CAS 386229-80-7), with molecular formula C12H20NO2S2+ and molecular weight 274.09 g/mol. IUPAC: trimethyl-[2-(4-methylphenyl)sulfonylsulfanylethyl]azanium.
Chemical Property Profile of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide
Property Insights of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide
The XLogP value of 2.12312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide. With a topological polar surface area (TPSA) of 34.14 Ų, [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide has 0 hydrogen bond donor(s) and 3 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-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide?
The CAS number of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide is 386229-80-7.
What is the molecular formula of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide?
The molecular formula of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide is C12H20NO2S2+.
What is the molecular weight of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide?
The molecular weight of [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide is 274.09 g/mol.
Where can I buy [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide?
You can request a quote for [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide?
Yes, KEHONG BIO provides custom synthesis services for [2-(Trimethylammonium)ethyl] Toluenethiosulfonate Bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.