N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide
TL;DR: N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide (CAS 663166-25-4) is a chemical compound with molecular formula C22H27ClN2O4S and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide
Also Known As: N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide
| Molecular Formula | C22H27ClN2O4S |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 4.3366 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.138 |
| Heavy Atoms | 30 |
| Complexity | 938.1077 |
Chemical Identifiers
| CAS Number | 663166-25-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide (CAS 663166-25-4), with molecular formula C22H27ClN2O4S and molecular weight 450.14 g/mol. IUPAC: N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide.
Chemical Property Profile of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide
Property Insights of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide
The XLogP value of 4.3366 indicates that N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide 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 N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide?
The CAS number of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide is 663166-25-4.
What is the molecular formula of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide?
The molecular formula of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide is C22H27ClN2O4S.
What is the molecular weight of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide?
The molecular weight of N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide is 450.14 g/mol.
Where can I buy N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide?
You can request a quote for N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(azepan-1-yl)-2-oxoethyl]-4-chloro-N-(4-ethoxyphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.