Ethyl 4-(methylsulfonyl)piperazinecarboxylate
TL;DR: Ethyl 4-(methylsulfonyl)piperazinecarboxylate (CAS 349403-24-3) is a chemical compound with molecular formula C8H16N2O4S and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methylsulfonylpiperazine-1-carboxylate
Also Known As: Ethyl 4-methylsulfonylpiperazine-1-carboxylate, ethyl 4-(methylsulfonyl)piperazinecarboxylate, ethyl 4-methanesulfonylpiperazine-1-carboxylate, ethyl 4-(methylsulfonyl)-1-piperazinecarboxylate, ethyl 4-(methylsulfonyl)piperazine-1-carboxylate
| Molecular Formula | C8H16N2O4S |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.08308 |
| Heavy Atoms | 15 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 349403-24-3 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)C |
| InChIKey | QSDFYHFWELYRMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4-(methylsulfonyl)piperazinecarboxylate (CAS 349403-24-3), with molecular formula C8H16N2O4S and molecular weight 236.08 g/mol. IUPAC: ethyl 4-methylsulfonylpiperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-(methylsulfonyl)piperazinecarboxylate
Property Insights of Ethyl 4-(methylsulfonyl)piperazinecarboxylate
The XLogP value of -0.4 indicates that Ethyl 4-(methylsulfonyl)piperazinecarboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(methylsulfonyl)piperazinecarboxylate. Following Lipinski's Rule of Five, Ethyl 4-(methylsulfonyl)piperazinecarboxylate 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 Ethyl 4-(methylsulfonyl)piperazinecarboxylate?
The CAS number of Ethyl 4-(methylsulfonyl)piperazinecarboxylate is 349403-24-3.
What is the molecular formula of Ethyl 4-(methylsulfonyl)piperazinecarboxylate?
The molecular formula of Ethyl 4-(methylsulfonyl)piperazinecarboxylate is C8H16N2O4S.
What is the molecular weight of Ethyl 4-(methylsulfonyl)piperazinecarboxylate?
The molecular weight of Ethyl 4-(methylsulfonyl)piperazinecarboxylate is 236.08 g/mol.
Where can I buy Ethyl 4-(methylsulfonyl)piperazinecarboxylate?
You can request a quote for Ethyl 4-(methylsulfonyl)piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(methylsulfonyl)piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(methylsulfonyl)piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.