![Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- structure](/static/products/5994/5994-45-6.webp)
Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-
TL;DR: Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- (CAS 5994-45-6) 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-4-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine
Also Known As: BIM-0039953.P001, piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-, 1-(pyridin-4-ylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine, 1-(4-pyridinylmethyl)-4-[2-(trifluoromethyl)benzyl]piperazine, 1-(4-pyridylmethyl)-4-[2-(trifluoromethyl)benzyl]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 | 374.0 |
Chemical Identifiers
| CAS Number | 5994-45-6 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=NC=C2)CC3=CC=CC=C3C(F)(F)F |
| InChIKey | BKBHILWTSQUNSO-UHFFFAOYSA-N |
Product Overview
Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- (CAS 5994-45-6), with molecular formula C18H20F3N3 and molecular weight 335.16 g/mol. IUPAC: 1-(pyridin-4-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine.
Chemical Property Profile of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-
Property Insights of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-. With a topological polar surface area (TPSA) of 19.4 Ų, Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- 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 Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-?
The CAS number of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- is 5994-45-6.
What is the molecular formula of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-?
The molecular formula of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- is C18H20F3N3.
What is the molecular weight of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-?
The molecular weight of Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- is 335.16 g/mol.
Where can I buy Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-?
You can request a quote for Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1-(4-pyridinylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.