2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester
TL;DR: 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester (CAS 716339-93-4) is a chemical compound with molecular formula C19H17NO4 and molecular weight 323.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methyl-2-oxo-1H-quinolin-3-yl)methyl 2-phenoxyacetate
Also Known As: (8-methyl-2-oxo-1H-quinolin-3-yl)methyl 2-phenoxyacetate, 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester, (2-HYDROXY-8-METHYLQUINOLIN-3-YL)METHYL 2-PHENOXYACETATE, (8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl phenoxyacetate
| Molecular Formula | C19H17NO4 |
|---|---|
| Molecular Weight | 323.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.11575 |
| Heavy Atoms | 24 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 716339-93-4 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C=C(C(=O)N2)COC(=O)COC3=CC=CC=C3 |
| InChIKey | AARVRAZYIRDYCJ-UHFFFAOYSA-N |
Product Overview
2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester (CAS 716339-93-4), with molecular formula C19H17NO4 and molecular weight 323.12 g/mol. IUPAC: (8-methyl-2-oxo-1H-quinolin-3-yl)methyl 2-phenoxyacetate.
Chemical Property Profile of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester
Property Insights of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester
The XLogP value of 3.1 indicates that 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester. Following Lipinski's Rule of Five, 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester has 1 hydrogen bond donor(s) and 4 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-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester?
The CAS number of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester is 716339-93-4.
What is the molecular formula of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester?
The molecular formula of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester is C19H17NO4.
What is the molecular weight of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester?
The molecular weight of 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester is 323.12 g/mol.
Where can I buy 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester?
You can request a quote for 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-phenoxyacetic acid (8-methyl-2-oxo-1H-quinolin-3-yl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.