1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine
TL;DR: 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine (CAS 898655-25-9) is a chemical compound with molecular formula C21H28N2O4S and molecular weight 404.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-diethoxyphenyl)sulfonyl-4-(2-methylphenyl)piperazine
Also Known As: UPCMLD0ENAT5942569:001, 1-(3,4-diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine, 1-(3,4-diethoxyphenyl)sulfonyl-4-(2-methylphenyl)piperazine, 1-[(3,4-diethoxyphenyl)sulfonyl]-4-(2-methylphenyl)piperazine
| Molecular Formula | C21H28N2O4S |
|---|---|
| Molecular Weight | 404.18 g/mol |
| LogP | 3.30332 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.17697 |
| Heavy Atoms | 28 |
| Complexity | 906.37164 |
Chemical Identifiers
| CAS Number | 898655-25-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3C)OCC |
Product Overview
1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine (CAS 898655-25-9), with molecular formula C21H28N2O4S and molecular weight 404.18 g/mol. IUPAC: 1-(3,4-diethoxyphenyl)sulfonyl-4-(2-methylphenyl)piperazine.
Chemical Property Profile of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine
Property Insights of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine
The XLogP value of 3.30332 indicates that 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.08 Ų, 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine has 0 hydrogen bond donor(s) and 5 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-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine?
The CAS number of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine is 898655-25-9.
What is the molecular formula of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine?
The molecular formula of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine is C21H28N2O4S.
What is the molecular weight of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine?
The molecular weight of 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine is 404.18 g/mol.
Where can I buy 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine?
You can request a quote for 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Diethoxybenzenesulfonyl)-4-(2-methylphenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.