N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide
TL;DR: N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide (CAS 228726-59-8) is a chemical compound with molecular formula C20H15ClN2O3 and molecular weight 366.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide
Also Known As: J1.689.938K, N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide, 3-Quinolinecarboxamide, N-((4-chlorophenyl)methyl)-4-hydroxy-6-(3-hydroxy-1-propyn-1-yl)-, 3-Quinolinecarboxamide, N-((4-chlorophenyl)methyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-, N-((4-Chlorophenyl)methyl)-4-hydroxy-6-(3-hydroxyprop-1-yn-1-yl)quinoline-3-carboxamide
| Molecular Formula | C20H15ClN2O3 |
|---|---|
| Molecular Weight | 366.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.07712 |
| Heavy Atoms | 26 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 228726-59-8 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)C#CCO)Cl |
| InChIKey | LHCASPYXLIAHLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide (CAS 228726-59-8), with molecular formula C20H15ClN2O3 and molecular weight 366.08 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide.
Chemical Property Profile of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide
Property Insights of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide
The XLogP value of 3.2 indicates that N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide. Following Lipinski's Rule of Five, N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide has 3 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 N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide?
The CAS number of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide is 228726-59-8.
What is the molecular formula of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide?
The molecular formula of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide is C20H15ClN2O3.
What is the molecular weight of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide?
The molecular weight of N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide is 366.08 g/mol.
Where can I buy N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide?
You can request a quote for N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorobenzyl)-4-hydroxy-6-(3-hydroxy-1-propynyl)-3-quinolinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.