Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate
TL;DR: Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate (CAS 252959-76-5) is a chemical compound with molecular formula C12H9F3N2O2 and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate
Also Known As: ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate, Peakdale1_000021, 1,8-Naphthyridine-3-carboxylicacid,2-(trifluoromethyl)-,ethylester(9CI), 1,8-Naphthyridine-3-carboxylicacid,2- -,ethylester, ethyl2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate
| Molecular Formula | C12H9F3N2O2 |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 2.8253 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.0616 |
| Heavy Atoms | 19 |
| Complexity | 625.89087 |
Chemical Identifiers
| CAS Number | 252959-76-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2C(=C1)C=CC=N2)C(F)(F)F |
Product Overview
Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate (CAS 252959-76-5), with molecular formula C12H9F3N2O2 and molecular weight 270.06 g/mol. IUPAC: ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate.
Chemical Property Profile of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate
Property Insights of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate
The XLogP value of 2.8253 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate. With a topological polar surface area (TPSA) of 52.08 Ų, Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate 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 Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate?
The CAS number of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate is 252959-76-5.
What is the molecular formula of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate?
The molecular formula of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate is C12H9F3N2O2.
What is the molecular weight of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate?
The molecular weight of Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate is 270.06 g/mol.
Where can I buy Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate?
You can request a quote for Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.