1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine
TL;DR: 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine (CAS 832684-00-1) is a chemical compound with molecular formula C22H30N2O3S and molecular weight 402.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-tert-butyl-2-ethoxyphenyl)sulfonyl-4-phenylpiperazine
Also Known As: 1-(5-tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine, 1-(5-tert-butyl-2-ethoxyphenyl)sulfonyl-4-phenylpiperazine, 1-{[5-(tert-butyl)-2-ethoxyphenyl]sulfonyl}-4-phenylpiperazine
| Molecular Formula | C22H30N2O3S |
|---|---|
| Molecular Weight | 402.20 g/mol |
| LogP | 3.8937 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.19772 |
| Heavy Atoms | 28 |
| Complexity | 897.12427 |
Chemical Identifiers
| CAS Number | 832684-00-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3 |
Product Overview
1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine (CAS 832684-00-1), with molecular formula C22H30N2O3S and molecular weight 402.20 g/mol. IUPAC: 1-(5-tert-butyl-2-ethoxyphenyl)sulfonyl-4-phenylpiperazine.
Chemical Property Profile of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine
Property Insights of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine
The XLogP value of 3.8937 indicates that 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine 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-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine 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-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine?
The CAS number of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine is 832684-00-1.
What is the molecular formula of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine?
The molecular formula of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine is C22H30N2O3S.
What is the molecular weight of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine?
The molecular weight of 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine is 402.20 g/mol.
Where can I buy 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine?
You can request a quote for 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Tert-butyl-2-ethoxybenzenesulfonyl)-4-phenylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.