![4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide structure](/static/products/6906/690697-89-3.webp)
4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
TL;DR: 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide (CAS 690697-89-3) is a chemical compound with molecular formula C17H17F3N4S and molecular weight 366.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Also Known As: 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide, 4-(pyridin-2-yl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide, 4-(2-pyridinyl)-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide
| Molecular Formula | C17H17F3N4S |
|---|---|
| Molecular Weight | 366.11 g/mol |
| LogP | 3.6194 |
| Topological Polar Surface Area | 31.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 366.1126 |
| Heavy Atoms | 25 |
| Complexity | 728.17285 |
Chemical Identifiers
| CAS Number | 690697-89-3 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide (CAS 690697-89-3), with molecular formula C17H17F3N4S and molecular weight 366.11 g/mol. IUPAC: 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide.
Chemical Property Profile of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Property Insights of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
The XLogP value of 3.6194 indicates that 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.4 Ų, 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 3 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-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
The CAS number of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is 690697-89-3.
What is the molecular formula of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
The molecular formula of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is C17H17F3N4S.
What is the molecular weight of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
The molecular weight of 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is 366.11 g/mol.
Where can I buy 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
You can request a quote for 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-pyridin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.