Propyl 2-hydroxyquinoline-4-carboxylate
TL;DR: Propyl 2-hydroxyquinoline-4-carboxylate (CAS 39497-03-5) is a chemical compound with molecular formula C13H13NO3 and molecular weight 231.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2-oxo-1H-quinoline-4-carboxylate
Also Known As: propyl 2-hydroxyquinoline-4-carboxylate, propyl 2-oxo-1H-quinoline-4-carboxylate, propyl 2-oxo-1,2-dihydroquinoline-4-carboxylate, BAS 06103656, 2-Hydroxy-quinoline-4-carboxylic acid propyl ester
| Molecular Formula | C13H13NO3 |
|---|---|
| Molecular Weight | 231.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.08954 |
| Heavy Atoms | 17 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 39497-03-5 |
|---|---|
| SMILES | CCCOC(=O)C1=CC(=O)NC2=CC=CC=C21 |
| InChIKey | FPPDXHVBLMXLFC-UHFFFAOYSA-N |
Product Overview
Propyl 2-hydroxyquinoline-4-carboxylate (CAS 39497-03-5), with molecular formula C13H13NO3 and molecular weight 231.09 g/mol. IUPAC: propyl 2-oxo-1H-quinoline-4-carboxylate.
Chemical Property Profile of Propyl 2-hydroxyquinoline-4-carboxylate
Property Insights of Propyl 2-hydroxyquinoline-4-carboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl 2-hydroxyquinoline-4-carboxylate. With a topological polar surface area (TPSA) of 55.4 Ų, Propyl 2-hydroxyquinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 2-hydroxyquinoline-4-carboxylate 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 Propyl 2-hydroxyquinoline-4-carboxylate?
The CAS number of Propyl 2-hydroxyquinoline-4-carboxylate is 39497-03-5.
What is the molecular formula of Propyl 2-hydroxyquinoline-4-carboxylate?
The molecular formula of Propyl 2-hydroxyquinoline-4-carboxylate is C13H13NO3.
What is the molecular weight of Propyl 2-hydroxyquinoline-4-carboxylate?
The molecular weight of Propyl 2-hydroxyquinoline-4-carboxylate is 231.09 g/mol.
Where can I buy Propyl 2-hydroxyquinoline-4-carboxylate?
You can request a quote for Propyl 2-hydroxyquinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 2-hydroxyquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 2-hydroxyquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.