RefChem:318902
TL;DR: RefChem:318902 (CAS 64049-71-4) is a chemical compound with molecular formula C20H34Br2N2O4 and molecular weight 524.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]-2-oxobutyl]-dimethylazanium dibromide
Also Known As: (4,beta-Phenethylenebis(carbonylmethyl))bis(dimethyl-2-hydroxyethylammonium) dibromide, Ammonium, (4,beta-phenethylenebis(carbonylmethyl))bis(dimethyl-2-hydroxyethyl-, dibromide, n-(2-hydroxyethyl)-4-(4-{[(2-hydroxyethyl)(dimethyl)ammonio]acetyl}phenyl)-n,n-dimethyl-2-oxobutan-1-aminium dibromide, 2-hydroxyethyl-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]-2-oxobutyl]-dimethylazanium dibromide, N-(2-Hydroxyethyl)-4-(4-{[(2-hydroxyethyl)(dimethyl)azaniumyl]acetyl}phenyl)-N,N-dimethyl-2-oxobutan-1-aminium dibromide
| Molecular Formula | C20H34Br2N2O4 |
|---|---|
| Molecular Weight | 524.09 g/mol |
| LogP | -5.48 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 526.0865 |
| Heavy Atoms | 28 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 64049-71-4 |
|---|---|
| SMILES | C[N+](C)(CCO)CC(=O)CCC1=CC=C(C=C1)C(=O)C[N+](C)(C)CCO.[Br-].[Br-] |
| InChIKey | YPHNHYLKSJGHQA-UHFFFAOYSA-L |
Product Overview
RefChem:318902 (CAS 64049-71-4), with molecular formula C20H34Br2N2O4 and molecular weight 524.09 g/mol. IUPAC: 2-hydroxyethyl-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]-2-oxobutyl]-dimethylazanium dibromide.
Chemical Property Profile of RefChem:318902
Property Insights of RefChem:318902
The XLogP value of -5.48 indicates that RefChem:318902 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:318902. Following Lipinski's Rule of Five, RefChem:318902 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:318902?
The CAS number of RefChem:318902 is 64049-71-4.
What is the molecular formula of RefChem:318902?
The molecular formula of RefChem:318902 is C20H34Br2N2O4.
What is the molecular weight of RefChem:318902?
The molecular weight of RefChem:318902 is 524.09 g/mol.
Where can I buy RefChem:318902?
You can request a quote for RefChem:318902 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318902?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318902 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.