![3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole structure](/static/products/4384/438463-89-9.webp)
3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole
TL;DR: 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole (CAS 438463-89-9) is a chemical compound with molecular formula C21H22F3N3 and molecular weight 373.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]-1H-indole
Also Known As: BIM-0036861.P001, 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole, 3-[[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]-1H-indole, 3-({4-[2-(trifluoromethyl)benzyl]-1-piperazinyl}methyl)-1H-indole
| Molecular Formula | C21H22F3N3 |
|---|---|
| Molecular Weight | 373.18 g/mol |
| LogP | 4.5045 |
| Topological Polar Surface Area | 22.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.17657 |
| Heavy Atoms | 27 |
| Complexity | 908.1759 |
Chemical Identifiers
| CAS Number | 438463-89-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2C(F)(F)F)CC3=CNC4=CC=CC=C43 |
Product Overview
3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole (CAS 438463-89-9), with molecular formula C21H22F3N3 and molecular weight 373.18 g/mol. IUPAC: 3-[[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]-1H-indole.
Chemical Property Profile of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole
Property Insights of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole
The XLogP value of 4.5045 indicates that 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.27 Ų, 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole has 1 hydrogen bond donor(s) and 2 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 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole?
The CAS number of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole is 438463-89-9.
What is the molecular formula of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole?
The molecular formula of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole is C21H22F3N3.
What is the molecular weight of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole?
The molecular weight of 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole is 373.18 g/mol.
Where can I buy 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole?
You can request a quote for 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-({4-[2-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.