5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide
TL;DR: 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide (CAS 736162-40-6) is a chemical compound with molecular formula C21H26N2O4S and molecular weight 402.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide
Also Known As: 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide, 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzene-1-sulfonamide
| Molecular Formula | C21H26N2O4S |
|---|---|
| Molecular Weight | 402.16 g/mol |
| LogP | 3.82062 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.16132 |
| Heavy Atoms | 28 |
| Complexity | 948.628 |
Chemical Identifiers
| CAS Number | 736162-40-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)N2CCCCCC2)S(=O)(=O)NC3=CC=CC=C3OC |
Product Overview
5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide (CAS 736162-40-6), with molecular formula C21H26N2O4S and molecular weight 402.16 g/mol. IUPAC: 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide.
Chemical Property Profile of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide
Property Insights of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide
The XLogP value of 3.82062 indicates that 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide. Following Lipinski's Rule of Five, 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide 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 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide?
The CAS number of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide is 736162-40-6.
What is the molecular formula of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide?
The molecular formula of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide is C21H26N2O4S.
What is the molecular weight of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide?
The molecular weight of 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide is 402.16 g/mol.
Where can I buy 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide?
You can request a quote for 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 5-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.