6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid
TL;DR: 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid (CAS 702669-58-7) is a chemical compound with molecular formula C16H18N2O5S and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic acid
Also Known As: 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid, 6-(azepan-1-ylsulfonyl)-2-oxo-1,2-dihydroquinoline-4-carboxylic acid, 6-(Azepane-1-sulfonyl)-2-oxo-1,2-dihydroquinoline-4-carboxylic acid, 6-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-1,2-dihydro-2-oxo-4-quinolinecarboxylic acid
| Molecular Formula | C16H18N2O5S |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 1.791 |
| Topological Polar Surface Area | 107.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.09363 |
| Heavy Atoms | 24 |
| Complexity | 940.58435 |
Chemical Identifiers
| CAS Number | 702669-58-7 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)O |
Product Overview
6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid (CAS 702669-58-7), with molecular formula C16H18N2O5S and molecular weight 350.09 g/mol. IUPAC: 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic acid.
Chemical Property Profile of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid
Property Insights of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid
The XLogP value of 1.791 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid. The TPSA of 107.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid. Following Lipinski's Rule of Five, 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid has 2 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 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid?
The CAS number of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid is 702669-58-7.
What is the molecular formula of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid?
The molecular formula of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid is C16H18N2O5S.
What is the molecular weight of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid?
The molecular weight of 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid is 350.09 g/mol.
Where can I buy 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid?
You can request a quote for 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.