1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine
TL;DR: 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine (CAS 433972-75-9) is a chemical compound with molecular formula C20H25BrN2O3S and molecular weight 452.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-2,5-dimethylphenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine
Also Known As: 1-(4-bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine, 1-(4-bromo-2,5-dimethylphenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine, 4-bromo-1-{[4-(2-ethoxyphenyl)piperazinyl]sulfonyl}-2,5-dimethylbenzene
| Molecular Formula | C20H25BrN2O3S |
|---|---|
| Molecular Weight | 452.08 g/mol |
| LogP | 3.97554 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 452.07693 |
| Heavy Atoms | 27 |
| Complexity | 922.8192 |
Chemical Identifiers
| CAS Number | 433972-75-9 |
|---|---|
| SMILES | CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)C)Br)C |
Product Overview
1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine (CAS 433972-75-9), with molecular formula C20H25BrN2O3S and molecular weight 452.08 g/mol. IUPAC: 1-(4-bromo-2,5-dimethylphenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine.
Chemical Property Profile of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine
Property Insights of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine
The XLogP value of 3.97554 indicates that 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine 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 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine?
The CAS number of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine is 433972-75-9.
What is the molecular formula of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine?
The molecular formula of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine is C20H25BrN2O3S.
What is the molecular weight of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine?
The molecular weight of 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine is 452.08 g/mol.
Where can I buy 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine?
You can request a quote for 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromo-2,5-dimethylbenzenesulfonyl)-4-(2-ethoxyphenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.