RefChem:138094
TL;DR: RefChem:138094 (CAS 68443-92-5) is a chemical compound with molecular formula C28H60N2O6S and molecular weight 552.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]azanium;ethyl sulfate
Also Known As: Ethanaminium, N,N-diethyl-N-(2-hydroxyethyl)-2-[(1-oxooctadecyl)amino]-, ethyl sulfate (salt), Stearyl triethyl ethanolamine, ethyl sulfate quaternary ammonium salt, (4-((4,5-Dimethylhexyl)oxy)-2-hydroxyphenyl) phenyl ketone, n,n-diethyl-2-hydroxy-n-[2-(stearoylamino)ethyl]ethanaminium ethyl sulfate, diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]azanium; ethyl sulfate
| Molecular Formula | C28H60N2O6S |
|---|---|
| Molecular Weight | 552.42 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 24 |
| Exact Mass | 552.41724 |
| Heavy Atoms | 37 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 68443-92-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CC)CCO.CCOS(=O)(=O)[O-] |
| InChIKey | STDNLQPRAPEPQC-UHFFFAOYSA-N |
Product Overview
RefChem:138094 (CAS 68443-92-5), with molecular formula C28H60N2O6S and molecular weight 552.42 g/mol. IUPAC: diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]azanium;ethyl sulfate.
Chemical Property Profile of RefChem:138094
Property Insights of RefChem:138094
The XLogP value of 5.7 indicates that RefChem:138094 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:138094. Following Lipinski's Rule of Five, RefChem:138094 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:138094?
The CAS number of RefChem:138094 is 68443-92-5.
What is the molecular formula of RefChem:138094?
The molecular formula of RefChem:138094 is C28H60N2O6S.
What is the molecular weight of RefChem:138094?
The molecular weight of RefChem:138094 is 552.42 g/mol.
Where can I buy RefChem:138094?
You can request a quote for RefChem:138094 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:138094?
Yes, KEHONG BIO provides custom synthesis services for RefChem:138094 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.