RefChem:186686
TL;DR: RefChem:186686 (CAS 4492-80-2) is a chemical compound with molecular formula C24H53NO7S and molecular weight 499.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;octadecyl hydrogen sulfate
Also Known As: tris ammoniumoctadecylsulphate, Tris(2-hydroxyethyl)ammonium octadecyl sulphate, 2-hydroxy-n,n-bis(2-hydroxyethyl)ethanaminium octadecyl sulfate, Sulfuric acid, monooctadecyl ester, compd. with 2,2',2''-nitrilotris[ethanol] (1:1), 2-[bis(2-hydroxyethyl)amino]ethanol,octadecyl hydrogen sulfate
| Molecular Formula | C24H53NO7S |
|---|---|
| Molecular Weight | 499.35 g/mol |
| LogP | 4.33 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 24 |
| Exact Mass | 499.35428 |
| Heavy Atoms | 33 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 4492-80-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO |
| InChIKey | DZQYCOCAFPQWBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:186686 (CAS 4492-80-2), with molecular formula C24H53NO7S and molecular weight 499.35 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;octadecyl hydrogen sulfate.
Chemical Property Profile of RefChem:186686
Property Insights of RefChem:186686
The XLogP value of 4.33 indicates that RefChem:186686 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:186686. Following Lipinski's Rule of Five, RefChem:186686 has 4 hydrogen bond donor(s) and 8 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 RefChem:186686?
The CAS number of RefChem:186686 is 4492-80-2.
What is the molecular formula of RefChem:186686?
The molecular formula of RefChem:186686 is C24H53NO7S.
What is the molecular weight of RefChem:186686?
The molecular weight of RefChem:186686 is 499.35 g/mol.
Where can I buy RefChem:186686?
You can request a quote for RefChem:186686 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:186686?
Yes, KEHONG BIO provides custom synthesis services for RefChem:186686 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.