Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate
TL;DR: Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate (CAS 260555-47-3) is a chemical compound with molecular formula C15H20F3N3O2 and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propanoate
Also Known As: Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate, ethyl 2-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazino}propanoate, ETHYL2-[4-[5- PYRIDIN-2-YL]PIPERAZINO]PROPANOATE, ETHYL 2-[4-[5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]PIPERAZINO]PROPANOATE, ethyl 2-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}propanoate
| Molecular Formula | C15H20F3N3O2 |
|---|---|
| Molecular Weight | 331.15 g/mol |
| LogP | 2.174 |
| Topological Polar Surface Area | 45.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.15076 |
| Heavy Atoms | 23 |
| Complexity | 525.7638 |
Chemical Identifiers
| CAS Number | 260555-47-3 |
|---|---|
| SMILES | CCOC(=O)C(C)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F |
Product Overview
Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate (CAS 260555-47-3), with molecular formula C15H20F3N3O2 and molecular weight 331.15 g/mol. IUPAC: ethyl 2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propanoate.
Chemical Property Profile of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate
Property Insights of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate
The XLogP value of 2.174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate. With a topological polar surface area (TPSA) of 45.67 Ų, Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate 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 Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate?
The CAS number of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate is 260555-47-3.
What is the molecular formula of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate?
The molecular formula of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate is C15H20F3N3O2.
What is the molecular weight of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate?
The molecular weight of Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate is 331.15 g/mol.
Where can I buy Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate?
You can request a quote for Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.