1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl
TL;DR: 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl (CAS 143759-99-3) is a chemical compound with molecular formula C30H38Cl2F2N2O2S and molecular weight 598.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-(3-methoxyphenyl)sulfanylpropan-2-ol;dihydrochloride
Also Known As: 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl, 1-Piperazineethanol, 4-(4,4-bis(4-fluorophenyl)butyl)-alpha-(((3-methoxyphenyl)thio)methyl)-,dihydrochloride, 1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-(3-methoxyphenyl)sulfanylpropan-2-ol dihydrochloride, 1-{4-[4,4-Bis(4-fluorophenyl)butyl]piperazin-1-yl}-3-[(3-methoxyphenyl)sulfanyl]propan-2-ol--hydrogen chloride (1/2), RefChem:233789
| Molecular Formula | C30H38Cl2F2N2O2S |
|---|---|
| Molecular Weight | 598.20 g/mol |
| LogP | 6.4999 |
| Topological Polar Surface Area | 35.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 598.1999 |
| Heavy Atoms | 39 |
| Complexity | 1055.3762 |
Chemical Identifiers
| CAS Number | 143759-99-3 |
|---|---|
| SMILES | COC1=CC(=CC=C1)SCC(CN2CCN(CC2)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)O.Cl.Cl |
Product Overview
1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl (CAS 143759-99-3), with molecular formula C30H38Cl2F2N2O2S and molecular weight 598.20 g/mol. IUPAC: 1-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-3-(3-methoxyphenyl)sulfanylpropan-2-ol;dihydrochloride.
Chemical Property Profile of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl
Property Insights of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl
The XLogP value of 6.4999 indicates that 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.94 Ų, 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl?
The CAS number of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl is 143759-99-3.
What is the molecular formula of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl?
The molecular formula of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl is C30H38Cl2F2N2O2S.
What is the molecular weight of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl?
The molecular weight of 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl is 598.20 g/mol.
Where can I buy 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl?
You can request a quote for 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,4-Bis(4-fluorophenyl)butyl)-4-(2-hydroxy-3-(3-methoxyphenylthio)propyl)piperazine 2HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.