Steapyrium Chloride
TL;DR: Steapyrium Chloride (CAS 14492-68-3) is a chemical compound with molecular formula C27H47ClN2O3 and molecular weight 482.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Steapyrium Chloride
2-[(2-pyridin-1-ium-1-ylacetyl)amino]ethyl octadecanoate chloride
Also Known As: Steapyrium chloride, Quaternium 7, Emcol E 607S, CATEMOL WPC, 1-[2-oxo-2-[[2-[(1-oxooctadecyl)oxy]ethyl]amino]ethyl]pyridinium chloride
| Molecular Formula | C27H47ClN2O3 |
|---|---|
| Molecular Weight | 482.33 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 22 |
| Exact Mass | 482.3275 |
| Heavy Atoms | 33 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 14492-68-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCCNC(=O)C[N+]1=CC=CC=C1.[Cl-] |
| InChIKey | LNEXUGPWTFNCSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Steapyrium Chloride (CAS 14492-68-3), with molecular formula C27H47ClN2O3 and molecular weight 482.33 g/mol. IUPAC: 2-[(2-pyridin-1-ium-1-ylacetyl)amino]ethyl octadecanoate chloride.
Chemical Property Profile of Steapyrium Chloride
Property Insights of Steapyrium Chloride
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Steapyrium Chloride. With a topological polar surface area (TPSA) of 59.3 Ų, Steapyrium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Steapyrium Chloride has 1 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 Steapyrium Chloride?
The CAS number of Steapyrium Chloride is 14492-68-3.
What is the molecular formula of Steapyrium Chloride?
The molecular formula of Steapyrium Chloride is C27H47ClN2O3.
What is the molecular weight of Steapyrium Chloride?
The molecular weight of Steapyrium Chloride is 482.33 g/mol.
Where can I buy Steapyrium Chloride?
You can request a quote for Steapyrium Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Steapyrium Chloride?
Yes, KEHONG BIO provides custom synthesis services for Steapyrium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.