Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate
TL;DR: Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate (CAS 69125-07-1) is a chemical compound with molecular formula C21H46N2O5S and molecular weight 438.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dodecanoylamino)propyl-ethyl-dimethylazanium;ethyl sulfate
Also Known As: EINECS 273-887-7, Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate, ethyldimethyl[3-[amino]propyl]ammoniumethylsulphate, ethyldimethyl[3-[ amino]propyl]ammoniumethylsulphate, 3-(dodecanoylamino)propyl-ethyl-dimethylazanium; ethyl sulfate
| Molecular Formula | C21H46N2O5S |
|---|---|
| Molecular Weight | 438.31 g/mol |
| LogP | 3.993 |
| Topological Polar Surface Area | 95.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 17 |
| Exact Mass | 438.31274 |
| Heavy Atoms | 29 |
| Complexity | 481.46313 |
Chemical Identifiers
| CAS Number | 69125-07-1 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-] |
Product Overview
Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate (CAS 69125-07-1), with molecular formula C21H46N2O5S and molecular weight 438.31 g/mol. IUPAC: 3-(dodecanoylamino)propyl-ethyl-dimethylazanium;ethyl sulfate.
Chemical Property Profile of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate
Property Insights of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate
The XLogP value of 3.993 indicates that Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.53 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate. Following Lipinski's Rule of Five, Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate has 1 hydrogen bond donor(s) and 5 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 Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate?
The CAS number of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate is 69125-07-1.
What is the molecular formula of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate?
The molecular formula of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate is C21H46N2O5S.
What is the molecular weight of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate?
The molecular weight of Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate is 438.31 g/mol.
Where can I buy Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate?
You can request a quote for Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate?
Yes, KEHONG BIO provides custom synthesis services for Ethyldimethyl(3-((1-oxododecyl)amino)propyl)ammonium ethyl sulphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.