2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid
TL;DR: 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid (CAS 96027-92-8) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid
Also Known As: 2-(1-ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid, 2-(1-Ethyl-1,4-dihydro-7-methoxy-4-oxoquinol-3-yl)ethanoic acid, 2-(1-ethyl-7-methoxy-4-oxo-quinolin-3-yl)acetic Acid, (1-Ethyl-7-methoxy-4-oxo-1,4-dihydroquinolin-3-yl)acetic acid
| Molecular Formula | C14H15NO4 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.1001 |
| Heavy Atoms | 19 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 96027-92-8 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=C1C=C(C=C2)OC)CC(=O)O |
| InChIKey | AVVCLLPOMIMMMQ-UHFFFAOYSA-N |
Product Overview
2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid (CAS 96027-92-8), with molecular formula C14H15NO4 and molecular weight 261.10 g/mol. IUPAC: 2-(1-ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid.
Chemical Property Profile of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid
Property Insights of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid. Following Lipinski's Rule of Five, 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid has 1 hydrogen bond donor(s) and 5 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 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid?
The CAS number of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid is 96027-92-8.
What is the molecular formula of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid?
The molecular formula of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid is C14H15NO4.
What is the molecular weight of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid?
The molecular weight of 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid is 261.10 g/mol.
Where can I buy 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid?
You can request a quote for 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Ethyl-7-methoxy-4-oxoquinolin-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.