![Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate structure](/static/products/881/881941-65-7.png)
Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate
TL;DR: Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate (CAS 881941-65-7) is a chemical compound with molecular formula C20H14F3N3O2 and molecular weight 385.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-cyanoanilino)-7-(trifluoromethyl)quinoline-3-carboxylate
Also Known As: SDCCGSBI-0659804.P001, ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate, ethyl 4-(4-cyanoanilino)-7-(trifluoromethyl)quinoline-3-carboxylate, F3174-0295, ethyl 4-((4-cyanophenyl)amino)-7-(trifluoromethyl)quinoline-3-carboxylate
| Molecular Formula | C20H14F3N3O2 |
|---|---|
| Molecular Weight | 385.10 g/mol |
| LogP | 5.04558 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.10382 |
| Heavy Atoms | 28 |
| Complexity | 1070.9766 |
Chemical Identifiers
| CAS Number | 881941-65-7 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=CC=C(C=C3)C#N)C(F)(F)F |
Product Overview
Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate (CAS 881941-65-7), with molecular formula C20H14F3N3O2 and molecular weight 385.10 g/mol. IUPAC: ethyl 4-(4-cyanoanilino)-7-(trifluoromethyl)quinoline-3-carboxylate.
Chemical Property Profile of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate
Property Insights of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate
The XLogP value of 5.04558 indicates that Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate?
The CAS number of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate is 881941-65-7.
What is the molecular formula of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate?
The molecular formula of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate is C20H14F3N3O2.
What is the molecular weight of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate?
The molecular weight of Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate is 385.10 g/mol.
Where can I buy Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate?
You can request a quote for Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-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 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(4-cyanophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.