![4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile structure](/static/products/3391/339102-59-9.webp)
4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile
TL;DR: 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile (CAS 339102-59-9) is a chemical compound with molecular formula C18H17F3N4O and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile
Also Known As: Bionet1_002467, 4-methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile, 8M-033, 4-methoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile, 4-methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyridine-3-carbonitrile
| Molecular Formula | C18H17F3N4O |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 3.30728 |
| Topological Polar Surface Area | 52.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.13544 |
| Heavy Atoms | 26 |
| Complexity | 823.9164 |
Chemical Identifiers
| CAS Number | 339102-59-9 |
|---|---|
| SMILES | COC1=C(C(=NC=C1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C#N |
Product Overview
4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile (CAS 339102-59-9), with molecular formula C18H17F3N4O and molecular weight 362.14 g/mol. IUPAC: 4-methoxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile.
Chemical Property Profile of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile
Property Insights of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile
The XLogP value of 3.30728 indicates that 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.39 Ų, 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile has 0 hydrogen bond donor(s) and 5 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 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile?
The CAS number of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile is 339102-59-9.
What is the molecular formula of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile?
The molecular formula of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile is C18H17F3N4O.
What is the molecular weight of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile?
The molecular weight of 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile is 362.14 g/mol.
Where can I buy 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile?
You can request a quote for 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-2-{4-[3-(trifluoromethyl)phenyl]piperazino}nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.