1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine
TL;DR: 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine (CAS 836664-20-1) is a chemical compound with molecular formula C12H18N2O2S2 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine
Also Known As: 1-methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine, AB01281001-01, 1-methyl-4-{[4-(methylsulfanyl)phenyl]sulfonyl}piperazine, 1-methyl-4-(4-methylsulfanylphenyl)sulfonyl-piperazine
| Molecular Formula | C12H18N2O2S2 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 1.3446 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.08096 |
| Heavy Atoms | 18 |
| Complexity | 491.31363 |
Chemical Identifiers
| CAS Number | 836664-20-1 |
|---|---|
| SMILES | CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)SC |
Product Overview
1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine (CAS 836664-20-1), with molecular formula C12H18N2O2S2 and molecular weight 286.08 g/mol. IUPAC: 1-methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine.
Chemical Property Profile of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine
Property Insights of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine
The XLogP value of 1.3446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine. With a topological polar surface area (TPSA) of 40.62 Ų, 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine 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-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine?
The CAS number of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine is 836664-20-1.
What is the molecular formula of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine?
The molecular formula of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine is C12H18N2O2S2.
What is the molecular weight of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine?
The molecular weight of 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine is 286.08 g/mol.
Where can I buy 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine?
You can request a quote for 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-(4-methylsulfanylphenyl)sulfonylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.