Dimecolin
TL;DR: Dimecolin (CAS 3425-97-6) is a chemical compound with molecular formula C14H30I2N2O2 and molecular weight 512.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-(1,1,6-trimethylpiperidin-1-ium-2-carbonyl)oxyethyl]azanium diiodide
Also Known As: Dimecolonium iodide, Dimecolin, Dimecholine, Dimecoline, Dimekolin
| Molecular Formula | C14H30I2N2O2 |
|---|---|
| Molecular Weight | 512.04 g/mol |
| LogP | -4.74 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 512.0397 |
| Heavy Atoms | 20 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 3425-97-6 |
|---|---|
| SMILES | CC1CCCC([N+]1(C)C)C(=O)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | UZOHFHFMSPULPR-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimecolin (CAS 3425-97-6), with molecular formula C14H30I2N2O2 and molecular weight 512.04 g/mol. IUPAC: trimethyl-[2-(1,1,6-trimethylpiperidin-1-ium-2-carbonyl)oxyethyl]azanium diiodide.
Chemical Property Profile of Dimecolin
Property Insights of Dimecolin
The XLogP value of -4.74 indicates that Dimecolin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, Dimecolin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimecolin has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimecolin?
The CAS number of Dimecolin is 3425-97-6.
What is the molecular formula of Dimecolin?
The molecular formula of Dimecolin is C14H30I2N2O2.
What is the molecular weight of Dimecolin?
The molecular weight of Dimecolin is 512.04 g/mol.
Where can I buy Dimecolin?
You can request a quote for Dimecolin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimecolin?
Yes, KEHONG BIO provides custom synthesis services for Dimecolin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.