![1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine structure](/static/products/3558/355820-85-8.webp)
1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine
TL;DR: 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine (CAS 355820-85-8) is a chemical compound with molecular formula C18H20F3N3 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(pyridin-3-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
Also Known As: BAS 01840369, AB00099741-01, 1-(pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine, 1-(3-pyridinylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine, 1-(pyridin-3-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
| Molecular Formula | C18H20F3N3 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 19.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.16092 |
| Heavy Atoms | 24 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 355820-85-8 |
|---|---|
| SMILES | C1CN(CCN1CC2=CN=CC=C2)CC3=CC=CC=C3C(F)(F)F |
| InChIKey | AABNIAABCZZPRT-UHFFFAOYSA-N |
Product Overview
1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine (CAS 355820-85-8), with molecular formula C18H20F3N3 and molecular weight 335.16 g/mol. IUPAC: 1-(pyridin-3-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine.
Chemical Property Profile of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine
Property Insights of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine. With a topological polar surface area (TPSA) of 19.4 Ų, 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine has 0 hydrogen bond donor(s) and 6 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-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine?
The CAS number of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine is 355820-85-8.
What is the molecular formula of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine?
The molecular formula of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine is C18H20F3N3.
What is the molecular weight of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine?
The molecular weight of 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine is 335.16 g/mol.
Where can I buy 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine?
You can request a quote for 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Pyridin-3-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.