2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester
TL;DR: 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester (CAS 111589-00-5) is a chemical compound with molecular formula C19H15NO3 and molecular weight 305.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-oxo-1-phenylpropan-2-yl) quinoline-2-carboxylate
Also Known As: TimTec1_007886, IDI1_033540, BAS 04999727, 2-quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester, (1-oxo-1-phenylpropan-2-yl) quinoline-2-carboxylate
| Molecular Formula | C19H15NO3 |
|---|---|
| Molecular Weight | 305.11 g/mol |
| LogP | 3.663 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.1052 |
| Heavy Atoms | 23 |
| Complexity | 858.63245 |
Chemical Identifiers
| CAS Number | 111589-00-5 |
|---|---|
| SMILES | CC(C(=O)C1=CC=CC=C1)OC(=O)C2=NC3=CC=CC=C3C=C2 |
Product Overview
2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester (CAS 111589-00-5), with molecular formula C19H15NO3 and molecular weight 305.11 g/mol. IUPAC: (1-oxo-1-phenylpropan-2-yl) quinoline-2-carboxylate.
Chemical Property Profile of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester
Property Insights of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester
The XLogP value of 3.663 indicates that 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester 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-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester?
The CAS number of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester is 111589-00-5.
What is the molecular formula of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester?
The molecular formula of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester is C19H15NO3.
What is the molecular weight of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester?
The molecular weight of 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester is 305.11 g/mol.
Where can I buy 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester?
You can request a quote for 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.