Sebacinyldicholine
TL;DR: Sebacinyldicholine (CAS 7095-43-4) is a chemical compound with molecular formula C20H42N2O4+2 and molecular weight 374.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-[10-oxo-10-[2-(trimethylazaniumyl)ethoxy]decanoyl]oxyethyl]azanium
Also Known As: Sebacinyldicholine, Sebacoyldicholine, trimethyl-[2-[10-oxo-10-[2-(trimethylazaniumyl)ethoxy]decanoyl]oxyethyl]azanium, 2,2'-[(1,10-Dioxodecane-1,10-diyl)bis(oxy)]bis(N,N,N-trimethylethan-1-aminium), Ethanaminium, 2,2'-((1,10-dioxo-1,10-decanediyl)bis(oxy))bis(N,N,N-trimethyl-
| Molecular Formula | C20H42N2O4+2 |
|---|---|
| Molecular Weight | 374.31 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 374.31445 |
| Heavy Atoms | 26 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 7095-43-4 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)CCCCCCCCC(=O)OCC[N+](C)(C)C |
| InChIKey | RQXCAEVLCRTBQC-UHFFFAOYSA-N |
Product Overview
Sebacinyldicholine (CAS 7095-43-4), with molecular formula C20H42N2O4+2 and molecular weight 374.31 g/mol. IUPAC: trimethyl-[2-[10-oxo-10-[2-(trimethylazaniumyl)ethoxy]decanoyl]oxyethyl]azanium.
Chemical Property Profile of Sebacinyldicholine
Property Insights of Sebacinyldicholine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sebacinyldicholine. With a topological polar surface area (TPSA) of 52.6 Ų, Sebacinyldicholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sebacinyldicholine has 0 hydrogen bond donor(s) and 4 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 Sebacinyldicholine?
The CAS number of Sebacinyldicholine is 7095-43-4.
What is the molecular formula of Sebacinyldicholine?
The molecular formula of Sebacinyldicholine is C20H42N2O4+2.
What is the molecular weight of Sebacinyldicholine?
The molecular weight of Sebacinyldicholine is 374.31 g/mol.
Where can I buy Sebacinyldicholine?
You can request a quote for Sebacinyldicholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sebacinyldicholine?
Yes, KEHONG BIO provides custom synthesis services for Sebacinyldicholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.