4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline
TL;DR: 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline (CAS 866846-15-3) is a chemical compound with molecular formula C22H23FN2O2S and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(azepan-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonylquinoline
Also Known As: 4-(azepan-1-yl)-6-fluoro-3-tosylquinoline, 4-(AZEPAN-1-YL)-6-FLUORO-3-(4-METHYLBENZENESULFONYL)QUINOLINE, 4-(azepan-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonylquinoline, F1605-1136, 4-(azepan-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonyl-quinoline
| Molecular Formula | C22H23FN2O2S |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 4.89552 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.14642 |
| Heavy Atoms | 28 |
| Complexity | 1103.335 |
Chemical Identifiers
| CAS Number | 866846-15-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCCCCC4)F |
Product Overview
4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline (CAS 866846-15-3), with molecular formula C22H23FN2O2S and molecular weight 398.15 g/mol. IUPAC: 4-(azepan-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonylquinoline.
Chemical Property Profile of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline
Property Insights of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline
The XLogP value of 4.89552 indicates that 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.27 Ų, 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline has 0 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 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline?
The CAS number of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline is 866846-15-3.
What is the molecular formula of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline?
The molecular formula of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline is C22H23FN2O2S.
What is the molecular weight of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline?
The molecular weight of 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline is 398.15 g/mol.
Where can I buy 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline?
You can request a quote for 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(Azepan-1-yl)-6-fluoro-3-tosylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.