7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid
TL;DR: 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid (CAS 344445-01-8) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid
Also Known As: 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid, 3-Quinolinecarboxylic acid, 7-(dimethylamino)-4-hydroxy-, 7-(dimethylamino)-4-hydroxy-quinoline-3-carboxylic acid, 3-Quinolinecarboxylic acid, 7-(dimethylamino)-1,4-dihydro-4-oxo-, 7-(Dimethylamino)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 344445-01-8 |
|---|---|
| SMILES | CN(C)C1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)O |
| InChIKey | UYNVFMKDZZRMFT-UHFFFAOYSA-N |
Product Overview
7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid (CAS 344445-01-8), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid
Property Insights of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid has 2 hydrogen bond donor(s) and 5 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 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid?
The CAS number of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid is 344445-01-8.
What is the molecular formula of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid?
The molecular formula of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid is C12H12N2O3.
What is the molecular weight of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid?
The molecular weight of 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid is 232.08 g/mol.
Where can I buy 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid?
You can request a quote for 7-(dimethylamino)-4-oxo-1H-quinoline-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 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-(dimethylamino)-4-oxo-1H-quinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.