1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine
TL;DR: 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine (CAS 496020-40-7) is a chemical compound with molecular formula C17H18ClIN2O2S and molecular weight 475.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-methylphenyl)-4-(4-iodophenyl)sulfonylpiperazine
Also Known As: 1-(3-chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine, 1-{[4-(3-chloro-4-methylphenyl)piperazinyl]sulfonyl}-4-iodobenzene
| Molecular Formula | C17H18ClIN2O2S |
|---|---|
| Molecular Weight | 475.98 g/mol |
| LogP | 3.76392 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 475.9822 |
| Heavy Atoms | 24 |
| Complexity | 832.16907 |
Chemical Identifiers
| CAS Number | 496020-40-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)I)Cl |
Product Overview
1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine (CAS 496020-40-7), with molecular formula C17H18ClIN2O2S and molecular weight 475.98 g/mol. IUPAC: 1-(3-chloro-4-methylphenyl)-4-(4-iodophenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine
Property Insights of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine
The XLogP value of 3.76392 indicates that 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine has 0 hydrogen bond donor(s) and 3 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-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine?
The CAS number of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine is 496020-40-7.
What is the molecular formula of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine?
The molecular formula of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine is C17H18ClIN2O2S.
What is the molecular weight of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine?
The molecular weight of 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine is 475.98 g/mol.
Where can I buy 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine?
You can request a quote for 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)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-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-methylphenyl)-4-(4-iodobenzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.