1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine
TL;DR: 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine (CAS 496014-29-0) is a chemical compound with molecular formula C18H21BrN2O4S and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-4-phenylpiperazine
Also Known As: 1-(2-bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine, 1-(2-bromo-4,5-dimethoxy-phenyl)sulfonyl-4-phenyl-piperazine, 2-bromo-4,5-dimethoxy-1-[(4-phenylpiperazinyl)sulfonyl]benzene
| Molecular Formula | C18H21BrN2O4S |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 2.9772 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.04053 |
| Heavy Atoms | 26 |
| Complexity | 866.2599 |
Chemical Identifiers
| CAS Number | 496014-29-0 |
|---|---|
| SMILES | COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3 |
Product Overview
1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine (CAS 496014-29-0), with molecular formula C18H21BrN2O4S and molecular weight 440.04 g/mol. IUPAC: 1-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-4-phenylpiperazine.
Chemical Property Profile of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine
Property Insights of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine
The XLogP value of 2.9772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine. With a topological polar surface area (TPSA) of 59.08 Ų, 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine 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-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine?
The CAS number of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine is 496014-29-0.
What is the molecular formula of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine?
The molecular formula of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine is C18H21BrN2O4S.
What is the molecular weight of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine?
The molecular weight of 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine is 440.04 g/mol.
Where can I buy 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine?
You can request a quote for 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-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-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromo-4,5-dimethoxybenzenesulfonyl)-4-phenylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.