![3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one structure](/static/products/899/899348-49-3.png)
3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one
TL;DR: 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one (CAS 899348-49-3) is a chemical compound with molecular formula C17H13F2NO3S and molecular weight 349.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dimethylphenyl)sulfonyl-6,7-difluoro-1H-quinolin-4-one
Also Known As: 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one, 3-(2,5-dimethylphenyl)sulfonyl-6,7-difluoro-1H-quinolin-4-one, 3-(2,5-dimethylbenzenesulfonyl)-6,7-difluoro-1,4-dihydroquinolin-4-one, 3-((2,5-Dimethylphenyl)sulfonyl)-6,7-difluoroquinolin-4(1H)-one, 3-(2,5-dimethylbenzenesulfonyl)-6,7-difluoroquinolin-4-ol
| Molecular Formula | C17H13F2NO3S |
|---|---|
| Molecular Weight | 349.06 g/mol |
| LogP | 3.25594 |
| Topological Polar Surface Area | 67.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.0584 |
| Heavy Atoms | 24 |
| Complexity | 1134.5162 |
Chemical Identifiers
| CAS Number | 899348-49-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)C2=CNC3=CC(=C(C=C3C2=O)F)F |
Product Overview
3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one (CAS 899348-49-3), with molecular formula C17H13F2NO3S and molecular weight 349.06 g/mol. IUPAC: 3-(2,5-dimethylphenyl)sulfonyl-6,7-difluoro-1H-quinolin-4-one.
Chemical Property Profile of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one
Property Insights of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one
The XLogP value of 3.25594 indicates that 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one. Following Lipinski's Rule of Five, 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one 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 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one?
The CAS number of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one is 899348-49-3.
What is the molecular formula of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one?
The molecular formula of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one is C17H13F2NO3S.
What is the molecular weight of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one?
The molecular weight of 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one is 349.06 g/mol.
Where can I buy 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one?
You can request a quote for 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2,5-dimethylphenyl)sulfonyl]-6,7-difluoroquinolin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.