2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride
TL;DR: 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride (CAS 680618-06-8) is a chemical compound with molecular formula C15H13ClFNO4S and molecular weight 357.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxy-5-[(4-fluorobenzoyl)amino]benzenesulfonyl chloride
Also Known As: 2-Ethoxy-5-(4-fluoro-benzoylamino)-benzenesulfonyl chloride, 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride, D,L-ISOBORNYLACETATE, 2-ethoxy-5-[(4-fluorobenzoyl)amino]benzenesulfonyl Chloride, 2-ETHOXY-5- -BENZENESULFONYLCHLORIDE
| Molecular Formula | C15H13ClFNO4S |
|---|---|
| Molecular Weight | 357.02 g/mol |
| LogP | 3.4042 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.02377 |
| Heavy Atoms | 23 |
| Complexity | 821.87054 |
Chemical Identifiers
| CAS Number | 680618-06-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)F)S(=O)(=O)Cl |
Product Overview
2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride (CAS 680618-06-8), with molecular formula C15H13ClFNO4S and molecular weight 357.02 g/mol. IUPAC: 2-ethoxy-5-[(4-fluorobenzoyl)amino]benzenesulfonyl chloride.
Chemical Property Profile of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride
Property Insights of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride
The XLogP value of 3.4042 indicates that 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride. Following Lipinski's Rule of Five, 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride has 1 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 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride?
The CAS number of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride is 680618-06-8.
What is the molecular formula of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride?
The molecular formula of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride is C15H13ClFNO4S.
What is the molecular weight of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride?
The molecular weight of 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride is 357.02 g/mol.
Where can I buy 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride?
You can request a quote for 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-5-(4-fluorobenzamido)benzene-1-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.