![2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile structure](/static/products/3387/338753-98-3.webp)
2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile
TL;DR: 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile (CAS 338753-98-3) is a chemical compound with molecular formula C14H16ClF3N4 and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-methylpropanenitrile
Also Known As: 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile, 5E-080, 2-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}-2-methylpropanenitrile, 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-methylpropanenitrile, 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-2-methyl-propanenitrile
| Molecular Formula | C14H16ClF3N4 |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 3.17798 |
| Topological Polar Surface Area | 43.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.10156 |
| Heavy Atoms | 22 |
| Complexity | 586.73126 |
Chemical Identifiers
| CAS Number | 338753-98-3 |
|---|---|
| SMILES | CC(C)(C#N)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile (CAS 338753-98-3), with molecular formula C14H16ClF3N4 and molecular weight 332.10 g/mol. IUPAC: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-methylpropanenitrile.
Chemical Property Profile of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile
Property Insights of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile
The XLogP value of 3.17798 indicates that 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.16 Ų, 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile has 0 hydrogen bond donor(s) and 4 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 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile?
The CAS number of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile is 338753-98-3.
What is the molecular formula of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile?
The molecular formula of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile is C14H16ClF3N4.
What is the molecular weight of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile?
The molecular weight of 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile is 332.10 g/mol.
Where can I buy 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile?
You can request a quote for 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-methylpropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.