IEM 574
TL;DR: IEM 574 (CAS 15209-47-9) is a chemical compound with molecular formula C40H52N2O6S2 and molecular weight 720.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfonate;1-methyl-1-[4-[4-[4-(1-methylpyrrolidin-1-ium-1-yl)phenyl]hexan-3-yl]phenyl]pyrrolidin-1-ium
Also Known As: IEM 574, Dibenzosulphomethylate-p,p'-bis(N-pyrrolidinyl-meso-3,4-diphenyl)hexane, (1,1'-(1,2-Diethylethylene)di-p-phenylene)bis(1-methylpyrrolidinium), dibenzenesulfonate, Pyrrolidinium, 1,1'-((1,2-diethyl-1,2-ethanediyl)di-p-phenylene)bis(1-methyl-, dibenzenesulfonate, meso-, Pyrrolidinium, 1,1'-((1,2-diethyl-1,2-ethanediyl)di-4,1-phenylene)bis(1-methyl-, (R-(R*,S*))-, dibenzenesulfonate
| Molecular Formula | C40H52N2O6S2 |
|---|---|
| Molecular Weight | 720.33 g/mol |
| LogP | 8.0172 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 720.32666 |
| Heavy Atoms | 50 |
| Complexity | 637.0 |
Chemical Identifiers
| CAS Number | 15209-47-9 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)[N+]2(CCCC2)C)C(CC)C3=CC=C(C=C3)[N+]4(CCCC4)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-] |
| InChIKey | RAJGJSAYAQOAPN-UHFFFAOYSA-L |
Product Overview
IEM 574 (CAS 15209-47-9), with molecular formula C40H52N2O6S2 and molecular weight 720.33 g/mol. IUPAC: benzenesulfonate;1-methyl-1-[4-[4-[4-(1-methylpyrrolidin-1-ium-1-yl)phenyl]hexan-3-yl]phenyl]pyrrolidin-1-ium.
Chemical Property Profile of IEM 574
Property Insights of IEM 574
The XLogP value of 8.0172 indicates that IEM 574 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for IEM 574. Following Lipinski's Rule of Five, IEM 574 has 0 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 IEM 574?
The CAS number of IEM 574 is 15209-47-9.
What is the molecular formula of IEM 574?
The molecular formula of IEM 574 is C40H52N2O6S2.
What is the molecular weight of IEM 574?
The molecular weight of IEM 574 is 720.33 g/mol.
Where can I buy IEM 574?
You can request a quote for IEM 574 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IEM 574?
Yes, KEHONG BIO provides custom synthesis services for IEM 574 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.