Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride
TL;DR: Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride (CAS 54468-75-6) is a chemical compound with molecular formula C22H44Cl2N2O4 and molecular weight 470.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-heptanoyloxyethyl)piperazin-1-yl]ethyl heptanoate;dihydrochloride
Also Known As: ETHANOL, 2,2'-(1,4-PIPERAZINYLENE)DI-, DIHEPTANOATE, DIHYDROCHLORIDE, 2,2'-(1,4-Piperazinylene)diethanol diheptanoate dihydrochloride, 2-[4-(2-Heptanoyloxyethyl)piperazin-1-yl]ethyl heptanoatedihydrochloride, 2-[4-(2-heptanoyloxyethyl)piperazin-1-yl]ethyl heptanoate dihydrochloride, (Piperazine-1,4-diyl)di(ethane-2,1-diyl) diheptanoate--hydrogen chloride (1/2)
| Molecular Formula | C22H44Cl2N2O4 |
|---|---|
| Molecular Weight | 470.27 g/mol |
| LogP | 4.47 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 470.26782 |
| Heavy Atoms | 30 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 54468-75-6 |
|---|---|
| SMILES | CCCCCCC(=O)OCCN1CCN(CC1)CCOC(=O)CCCCCC.Cl.Cl |
| InChIKey | FQYJXAKBWMPFSE-UHFFFAOYSA-N |
Product Overview
Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride (CAS 54468-75-6), with molecular formula C22H44Cl2N2O4 and molecular weight 470.27 g/mol. IUPAC: 2-[4-(2-heptanoyloxyethyl)piperazin-1-yl]ethyl heptanoate;dihydrochloride.
Chemical Property Profile of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride
Property Insights of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride
The XLogP value of 4.47 indicates that Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride has 2 hydrogen bond donor(s) and 6 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 Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride?
The CAS number of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride is 54468-75-6.
What is the molecular formula of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride?
The molecular formula of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride is C22H44Cl2N2O4.
What is the molecular weight of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride?
The molecular weight of Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride is 470.27 g/mol.
Where can I buy Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride?
You can request a quote for Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2,2'-(1,4-piperazinylene)di-, diheptanoate, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.