Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride
TL;DR: Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride (CAS 1052415-79-8) is a chemical compound with molecular formula C21H21ClN2O5 and molecular weight 416.1139 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride
Also Known As: diethyl 4-((4-hydroxyphenyl)amino)quinoline-3,6-dicarboxylate hydrochloride, diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate hydrochloride, diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride, Diethyl 4-[(4-hydroxyphenyl)amino]quinoline-3,6-dicarboxylate Hydrochloride
Technical Specifications
| Molecular Formula | C21H21ClN2O5 |
| Molecular Weight | 416.1139 g/mol |
| XLogP | 4.4592 |
| Topological Polar Surface Area (TPSA) | 97.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 416.1139 Da |
| Heavy Atoms | 29 |
| Complexity | 535.0 |
| SMILES | CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)O.Cl |
| InChIKey | LROOVSKQLDAVJW-UHFFFAOYSA-N |
Chemical Property Profile of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride
Property Insights of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride
The XLogP value of 4.4592 indicates that Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride. Following Lipinski's Rule of Five, Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride?
The CAS number of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride is 1052415-79-8.
What is the molecular formula of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride?
The molecular formula of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride is C21H21ClN2O5.
What is the molecular weight of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride?
The molecular weight of Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride is 416.1139 g/mol.
Where can I buy Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride?
You can request a quote for Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride?
Yes, CoreyChem provides custom synthesis services for Diethyl 4-(4-hydroxyanilino)quinoline-3,6-dicarboxylate;hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.