![1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine structure](/static/products/4195/419577-93-8.webp)
1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
TL;DR: 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine (CAS 419577-93-8) is a chemical compound with molecular formula C22H29F3N2 and molecular weight 378.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
Also Known As: 1-(2-adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine, 1-(2-adamantyl)-4-[2-(trifluoromethyl)benzyl]piperazine, 1-(ADAMANTAN-2-YL)-4-{[2-(TRIFLUOROMETHYL)PHENYL]METHYL}PIPERAZINE, 1-(tricyclo[3.3.1.1~3,7~]dec-2-yl)-4-[2-(trifluoromethyl)benzyl]piperazine
| Molecular Formula | C22H29F3N2 |
|---|---|
| Molecular Weight | 378.23 g/mol |
| LogP | 4.6477 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.22827 |
| Heavy Atoms | 27 |
| Complexity | 650.3806 |
Chemical Identifiers
| CAS Number | 419577-93-8 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2C(F)(F)F)C3C4CC5CC(C4)CC3C5 |
Product Overview
1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine (CAS 419577-93-8), with molecular formula C22H29F3N2 and molecular weight 378.23 g/mol. IUPAC: 1-(2-adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine.
Chemical Property Profile of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
Property Insights of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
The XLogP value of 4.6477 indicates that 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine has 0 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 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine?
The CAS number of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine is 419577-93-8.
What is the molecular formula of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine?
The molecular formula of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine is C22H29F3N2.
What is the molecular weight of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine?
The molecular weight of 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine is 378.23 g/mol.
Where can I buy 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine?
You can request a quote for 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Adamantyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.