1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride
TL;DR: 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride (CAS 5580-42-7) is a chemical compound with molecular formula C22H30Cl2F2N2O and molecular weight 446.17 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]piperazin-1-yl]ethanol;dihydrochloride
Also Known As: 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride, 4-(4,4-Bis(4-fluorophenyl)butyl)-1-piperazineethanol dihydrochloride, 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxyethyl)piperazine dihydrochloride, 2-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]ethanol dihydrochloride, 2-{4-[4,4-Bis(4-fluorophenyl)butyl]piperazin-1-yl}ethan-1-ol--hydrogen chloride (1/2)
| Molecular Formula | C22H30Cl2F2N2O |
|---|---|
| Molecular Weight | 446.17 g/mol |
| LogP | 4.3304 |
| Topological Polar Surface Area | 26.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 446.17032 |
| Heavy Atoms | 29 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 5580-42-7 |
|---|---|
| SMILES | C1CN(CCN1CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CCO.Cl.Cl |
| InChIKey | PURHKNDGJZBGHW-UHFFFAOYSA-N |
Product Overview
1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride (CAS 5580-42-7), with molecular formula C22H30Cl2F2N2O and molecular weight 446.17 g/mol. IUPAC: 2-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]ethanol;dihydrochloride.
Chemical Property Profile of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride
Property Insights of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride
The XLogP value of 4.3304 indicates that 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.7 Ų, 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride has 3 hydrogen bond donor(s) and 5 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 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride?
The CAS number of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride is 5580-42-7.
What is the molecular formula of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride?
The molecular formula of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride is C22H30Cl2F2N2O.
What is the molecular weight of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride?
The molecular weight of 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride is 446.17 g/mol.
Where can I buy 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride?
You can request a quote for 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.