4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide
TL;DR: 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide (CAS 588681-53-2) is a chemical compound with molecular formula C17H18BrFN2O4S and molecular weight 444.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromo-4,5-diethoxyphenyl)methylideneamino]-4-fluorobenzenesulfonamide
Also Known As: 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide, N-[(3-bromo-4,5-diethoxyphenyl)methylideneamino]-4-fluorobenzenesulfonamide, N'-[(3-Bromo-4,5-diethoxyphenyl)methylidene]-4-fluorobenzene-1-sulfonohydrazide, N-[(3-bromo-4,5-diethoxy-phenyl)methylideneamino]-4-fluoro-benzenesulfonamide
| Molecular Formula | C17H18BrFN2O4S |
|---|---|
| Molecular Weight | 444.02 g/mol |
| LogP | 3.698 |
| Topological Polar Surface Area | 76.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.01547 |
| Heavy Atoms | 26 |
| Complexity | 886.38104 |
Chemical Identifiers
| CAS Number | 588681-53-2 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)F)Br)OCC |
Product Overview
4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide (CAS 588681-53-2), with molecular formula C17H18BrFN2O4S and molecular weight 444.02 g/mol. IUPAC: N-[(3-bromo-4,5-diethoxyphenyl)methylideneamino]-4-fluorobenzenesulfonamide.
Chemical Property Profile of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide
Property Insights of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide
The XLogP value of 3.698 indicates that 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide. Following Lipinski's Rule of Five, 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide has 1 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-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide?
The CAS number of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide is 588681-53-2.
What is the molecular formula of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide?
The molecular formula of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide is C17H18BrFN2O4S.
What is the molecular weight of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide?
The molecular weight of 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide is 444.02 g/mol.
Where can I buy 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide?
You can request a quote for 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorobenzenesulfonic acid 2-[(3-bromo-4,5-diethoxyphenyl)methylene]hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.