2-Methyl-8-quinolinyl 2-oxopropanoate
TL;DR: 2-Methyl-8-quinolinyl 2-oxopropanoate (CAS 353515-82-9) is a chemical compound with molecular formula C13H11NO3 and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylquinolin-8-yl) 2-oxopropanoate
Also Known As: 2-methyl-8-quinolinyl 2-oxopropanoate, (2-methylquinolin-8-yl) 2-oxopropanoate, 2-methyl-8-quinolyl 2-oxopropanoate, AN-652/14705007
| Molecular Formula | C13H11NO3 |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 2.03762 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.0739 |
| Heavy Atoms | 17 |
| Complexity | 604.6361 |
Chemical Identifiers
| CAS Number | 353515-82-9 |
|---|---|
| SMILES | CC1=NC2=C(C=CC=C2OC(=O)C(=O)C)C=C1 |
Product Overview
2-Methyl-8-quinolinyl 2-oxopropanoate (CAS 353515-82-9), with molecular formula C13H11NO3 and molecular weight 229.07 g/mol. IUPAC: (2-methylquinolin-8-yl) 2-oxopropanoate.
Chemical Property Profile of 2-Methyl-8-quinolinyl 2-oxopropanoate
Property Insights of 2-Methyl-8-quinolinyl 2-oxopropanoate
The XLogP value of 2.03762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-8-quinolinyl 2-oxopropanoate. With a topological polar surface area (TPSA) of 56.26 Ų, 2-Methyl-8-quinolinyl 2-oxopropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-8-quinolinyl 2-oxopropanoate has 0 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-Methyl-8-quinolinyl 2-oxopropanoate?
The CAS number of 2-Methyl-8-quinolinyl 2-oxopropanoate is 353515-82-9.
What is the molecular formula of 2-Methyl-8-quinolinyl 2-oxopropanoate?
The molecular formula of 2-Methyl-8-quinolinyl 2-oxopropanoate is C13H11NO3.
What is the molecular weight of 2-Methyl-8-quinolinyl 2-oxopropanoate?
The molecular weight of 2-Methyl-8-quinolinyl 2-oxopropanoate is 229.07 g/mol.
Where can I buy 2-Methyl-8-quinolinyl 2-oxopropanoate?
You can request a quote for 2-Methyl-8-quinolinyl 2-oxopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-8-quinolinyl 2-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-8-quinolinyl 2-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.