1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
TL;DR: 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid (CAS 161804-12-2) is a chemical compound with molecular formula C16H19NO4 and molecular weight 289.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexyl-2,4-dioxoquinoline-3-carboxylic acid
Also Known As: 1-hexyl-2,4-dioxoquinoline-3-carboxylic acid, 1-hexyl-2,4-dioxo-quinoline-3-carboxylic Acid, 1-hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
| Molecular Formula | C16H19NO4 |
|---|---|
| Molecular Weight | 289.13 g/mol |
| LogP | 2.497 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 289.1314 |
| Heavy Atoms | 21 |
| Complexity | 567.1503 |
Chemical Identifiers
| CAS Number | 161804-12-2 |
|---|---|
| SMILES | CCCCCCN1C2=CC=CC=C2C(=O)C(C1=O)C(=O)O |
Product Overview
1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid (CAS 161804-12-2), with molecular formula C16H19NO4 and molecular weight 289.13 g/mol. IUPAC: 1-hexyl-2,4-dioxoquinoline-3-carboxylic acid.
Chemical Property Profile of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
Property Insights of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
The XLogP value of 2.497 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid 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 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
The CAS number of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid is 161804-12-2.
What is the molecular formula of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
The molecular formula of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid is C16H19NO4.
What is the molecular weight of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
The molecular weight of 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid is 289.13 g/mol.
Where can I buy 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
You can request a quote for 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexyl-2,4-dioxo-1,2,3,4-tetrahydroquinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.