Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate
TL;DR: Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate (CAS 459418-05-4) is a chemical compound with molecular formula C23H26N2O3 and molecular weight 378.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-butoxyanilino)-8-methylquinoline-3-carboxylate
Also Known As: ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate, ethyl 4-(2-butoxyanilino)-8-methylquinoline-3-carboxylate, ethyl 4-((2-butoxyphenyl)amino)-8-methylquinoline-3-carboxylate
| Molecular Formula | C23H26N2O3 |
|---|---|
| Molecular Weight | 378.19 g/mol |
| LogP | 5.64242 |
| Topological Polar Surface Area | 60.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 378.19434 |
| Heavy Atoms | 28 |
| Complexity | 969.2187 |
Chemical Identifiers
| CAS Number | 459418-05-4 |
|---|---|
| SMILES | CCCCOC1=CC=CC=C1NC2=C(C=NC3=C(C=CC=C32)C)C(=O)OCC |
Product Overview
Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate (CAS 459418-05-4), with molecular formula C23H26N2O3 and molecular weight 378.19 g/mol. IUPAC: ethyl 4-(2-butoxyanilino)-8-methylquinoline-3-carboxylate.
Chemical Property Profile of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate
Property Insights of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate
The XLogP value of 5.64242 indicates that Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.45 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-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-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate?
The CAS number of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate is 459418-05-4.
What is the molecular formula of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate?
The molecular formula of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate is C23H26N2O3.
What is the molecular weight of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate?
The molecular weight of Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate is 378.19 g/mol.
Where can I buy Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate?
You can request a quote for Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-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-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(2-butoxyphenyl)amino]-8-methylquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.