4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline
TL;DR: 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline (CAS 899993-74-9) is a chemical compound with molecular formula C22H24FN3O2S and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-ethylpiperazin-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonylquinoline
Also Known As: 4-(4-ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline, VU0511050-1, 4-(4-ETHYLPIPERAZIN-1-YL)-6-FLUORO-3-(4-METHYLBENZENESULFONYL)QUINOLINE, 4-(4-ethylpiperazin-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonylquinoline, F3165-0120
| Molecular Formula | C22H24FN3O2S |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 3.65702 |
| Topological Polar Surface Area | 53.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.15732 |
| Heavy Atoms | 29 |
| Complexity | 1138.6812 |
Chemical Identifiers
| CAS Number | 899993-74-9 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=C(C=C4)C)F |
Product Overview
4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline (CAS 899993-74-9), with molecular formula C22H24FN3O2S and molecular weight 413.16 g/mol. IUPAC: 4-(4-ethylpiperazin-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonylquinoline.
Chemical Property Profile of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline
Property Insights of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline
The XLogP value of 3.65702 indicates that 4-(4-Ethylpiperazin-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 53.51 Ų, 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline has 0 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 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline?
The CAS number of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline is 899993-74-9.
What is the molecular formula of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline?
The molecular formula of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline is C22H24FN3O2S.
What is the molecular weight of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline?
The molecular weight of 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline is 413.16 g/mol.
Where can I buy 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline?
You can request a quote for 4-(4-Ethylpiperazin-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-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Ethylpiperazin-1-yl)-6-fluoro-3-tosylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.