1-(Methylsulfonyl)piperazine
TL;DR: 1-(Methylsulfonyl)piperazine (CAS 53617-36-0) is a chemical compound with molecular formula C5H12N2O2S and molecular weight 164.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonylpiperazine
Also Known As: 1-(methylsulfonyl)piperazine, 1-Methanesulfonylpiperazine, 1-Methanesulfonyl-piperazine, 1-methylsulfonylpiperazine, 1-Methylsulfonyl-piperazine
| Molecular Formula | C5H12N2O2S |
|---|---|
| Molecular Weight | 164.06 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.06195 |
| Heavy Atoms | 10 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 53617-36-0 |
|---|---|
| SMILES | CS(=O)(=O)N1CCNCC1 |
| InChIKey | ZZAKLGGGMWORRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Methylsulfonyl)piperazine (CAS 53617-36-0), with molecular formula C5H12N2O2S and molecular weight 164.06 g/mol. IUPAC: 1-methylsulfonylpiperazine.
Chemical Property Profile of 1-(Methylsulfonyl)piperazine
Property Insights of 1-(Methylsulfonyl)piperazine
The XLogP value of -1.1 indicates that 1-(Methylsulfonyl)piperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.8 Ų, 1-(Methylsulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Methylsulfonyl)piperazine has 1 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-(Methylsulfonyl)piperazine?
The CAS number of 1-(Methylsulfonyl)piperazine is 53617-36-0.
What is the molecular formula of 1-(Methylsulfonyl)piperazine?
The molecular formula of 1-(Methylsulfonyl)piperazine is C5H12N2O2S.
What is the molecular weight of 1-(Methylsulfonyl)piperazine?
The molecular weight of 1-(Methylsulfonyl)piperazine is 164.06 g/mol.
Where can I buy 1-(Methylsulfonyl)piperazine?
You can request a quote for 1-(Methylsulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Methylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.