Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate
TL;DR: Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate (CAS 459419-00-2) is a chemical compound with molecular formula C18H22N2O5 and molecular weight 346.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-(2-hydroxypropylamino)quinoline-3,6-dicarboxylate
Also Known As: BAS 03755326, diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate, diethyl 4-(2-hydroxypropylamino)quinoline-3,6-dicarboxylate, diethyl 4-((2-hydroxypropyl)amino)quinoline-3,6-dicarboxylate, diethyl 4-[(2-hydroxypropyl)amino]-3,6-quinolinedicarboxylate
| Molecular Formula | C18H22N2O5 |
|---|---|
| Molecular Weight | 346.15 g/mol |
| LogP | 2.3809 |
| Topological Polar Surface Area | 97.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 346.15286 |
| Heavy Atoms | 25 |
| Complexity | 768.1456 |
Chemical Identifiers
| CAS Number | 459419-00-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NCC(C)O |
Product Overview
Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate (CAS 459419-00-2), with molecular formula C18H22N2O5 and molecular weight 346.15 g/mol. IUPAC: diethyl 4-(2-hydroxypropylamino)quinoline-3,6-dicarboxylate.
Chemical Property Profile of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate
Property Insights of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate
The XLogP value of 2.3809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate. The TPSA of 97.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate has 2 hydrogen bond donor(s) and 7 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 Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate?
The CAS number of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate is 459419-00-2.
What is the molecular formula of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate?
The molecular formula of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate is C18H22N2O5.
What is the molecular weight of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate?
The molecular weight of Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate is 346.15 g/mol.
Where can I buy Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate?
You can request a quote for Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 4-[(2-hydroxypropyl)amino]quinoline-3,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.