4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester
TL;DR: 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester (CAS 63228-51-3) is a chemical compound with molecular formula C11H9NO3 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-oxo-1H-quinoline-4-carboxylate
Also Known As: methyl 2-oxo-1,2-dihydroquinoline-4-carboxylate, methyl 2-hydroxyquinoline-4-carboxylate, starbld0023823, methyl 2-oxo-1H-quinoline-4-carboxylate, ChemDiv2_003162
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 63228-51-3 |
|---|---|
| SMILES | COC(=O)C1=CC(=O)NC2=CC=CC=C21 |
| InChIKey | VVZNRIXRLYHAKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester (CAS 63228-51-3), with molecular formula C11H9NO3 and molecular weight 203.06 g/mol. IUPAC: methyl 2-oxo-1H-quinoline-4-carboxylate.
Chemical Property Profile of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester
Property Insights of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester has 1 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 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester?
The CAS number of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester is 63228-51-3.
What is the molecular formula of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester?
The molecular formula of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester is C11H9NO3.
What is the molecular weight of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester?
The molecular weight of 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester is 203.06 g/mol.
Where can I buy 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester?
You can request a quote for 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.