cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide
TL;DR: cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide (CAS 54088-40-3) is a chemical compound with molecular formula C21H25BrF3NO2 and molecular weight 459.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4R)-3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine;hydrobromide
Also Known As: cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide, Piperidine, 3-((4-methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)-, hydrobromide, cis-(+-)-, (3R,4R)-3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide, (3R,4R)-3-[(4-Methoxyphenoxy)methyl]-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine--hydrogen bromide (1/1), 3-[(4-Methoxyphenoxy)methyl]-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine--hydrogen bromide (1/1)
| Molecular Formula | C21H25BrF3NO2 |
|---|---|
| Molecular Weight | 459.10 g/mol |
| LogP | 5.3199 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 459.10208 |
| Heavy Atoms | 28 |
| Complexity | 709.8407 |
Chemical Identifiers
| CAS Number | 54088-40-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OC[C@H]2CN(CC[C@H]2C3=CC=CC=C3)CC(F)(F)F.Br |
Product Overview
cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide (CAS 54088-40-3), with molecular formula C21H25BrF3NO2 and molecular weight 459.10 g/mol. IUPAC: (3R,4R)-3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine;hydrobromide.
Chemical Property Profile of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide
Property Insights of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide
The XLogP value of 5.3199 indicates that cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide?
The CAS number of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide is 54088-40-3.
What is the molecular formula of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide?
The molecular formula of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide is C21H25BrF3NO2.
What is the molecular weight of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide?
The molecular weight of cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide is 459.10 g/mol.
Where can I buy cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide?
You can request a quote for cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for cis-(+-)-3-((4-Methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)piperidine hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.