1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester
TL;DR: 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester (CAS 38428-16-9) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-ethoxy-2H-quinoline-1-carboxylate
Also Known As: 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester, 2-methylpropyl 2-ethoxy-2H-quinoline-1-carboxylate, Isobutyl 2-ethoxy-1(2H)-quinolinecarboxylate #, 2-Methylpropyl 2-ethoxyquinoline-1(2H)-carboxylate, 2-ethoxy-2H-quinoline-1-carboxylic acid isobutyl ester
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 38428-16-9 |
|---|---|
| SMILES | CCOC1C=CC2=CC=CC=C2N1C(=O)OCC(C)C |
| InChIKey | PXSFFHCHRCZARW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester (CAS 38428-16-9), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 2-methylpropyl 2-ethoxy-2H-quinoline-1-carboxylate.
Chemical Property Profile of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester
Property Insights of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester
The XLogP value of 3.7 indicates that 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester has 0 hydrogen bond donor(s) and 3 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 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester?
The CAS number of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester is 38428-16-9.
What is the molecular formula of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester?
The molecular formula of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester is C16H21NO3.
What is the molecular weight of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester?
The molecular weight of 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester is 275.15 g/mol.
Where can I buy 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester?
You can request a quote for 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1(2H)-Quinolinecarboxylic acid, 2-ethoxy-, 2-methylpropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.