1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide
TL;DR: 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide (CAS 68351-17-7) is a chemical compound with molecular formula C26H36F2I2N2O2 and molecular weight 700.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[4,4-bis(4-fluorophenyl)butyl]-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl acetate diiodide
Also Known As: 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide, 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-acetoxyethyl)piperazine dimethiodide, Piperazinium, 1-(2-(acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethyl-, diiodide, 1-[2-(Acetyloxy)ethyl]-4-[4,4-bis(4-fluorophenyl)butyl]-1,4-dimethylpiperazine-1,4-diium diiodide, 2-[4-[4,4-bis(4-fluorophenyl)butyl]-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl acetate diiodide
| Molecular Formula | C26H36F2I2N2O2 |
|---|---|
| Molecular Weight | 700.08 g/mol |
| LogP | -1.6452 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 700.08344 |
| Heavy Atoms | 34 |
| Complexity | 841.1785 |
Chemical Identifiers
| CAS Number | 68351-17-7 |
|---|---|
| SMILES | CC(=O)OCC[N+]1(CC[N+](CC1)(C)CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C.[I-].[I-] |
Product Overview
1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide (CAS 68351-17-7), with molecular formula C26H36F2I2N2O2 and molecular weight 700.08 g/mol. IUPAC: 2-[4-[4,4-bis(4-fluorophenyl)butyl]-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl acetate diiodide.
Chemical Property Profile of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide
Property Insights of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide
The XLogP value of -1.6452 indicates that 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide 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, 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide?
The CAS number of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide is 68351-17-7.
What is the molecular formula of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide?
The molecular formula of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide is C26H36F2I2N2O2.
What is the molecular weight of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide?
The molecular weight of 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide is 700.08 g/mol.
Where can I buy 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide?
You can request a quote for 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(Acetyloxy)ethyl)-4-(4,4-bis(4-fluorophenyl)butyl)-1,4-dimethylpiperazinium diiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.