![1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester structure](/static/products/887/88708-36-5.png)
1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester
TL;DR: 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester (CAS 88708-36-5) is a chemical compound with molecular formula C10H20N2O2S and molecular weight 232.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-methylsulfanylethyl)piperazine-1-carboxylate
Also Known As: 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester, AE-641/00335019, ethyl 4-(2-methylsulfanylethyl)piperazine-1-carboxylate, ethyl 4-[2-(methylsulfanyl)ethyl]-1-piperazinecarboxylate, ETHYL 4-[2-(METHYLSULFANYL)ETHYL]PIPERAZINE-1-CARBOXYLATE
| Molecular Formula | C10H20N2O2S |
|---|---|
| Molecular Weight | 232.12 g/mol |
| LogP | 1.1235 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.12454 |
| Heavy Atoms | 15 |
| Complexity | 193.8614 |
Chemical Identifiers
| CAS Number | 88708-36-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CCSC |
Product Overview
1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester (CAS 88708-36-5), with molecular formula C10H20N2O2S and molecular weight 232.12 g/mol. IUPAC: ethyl 4-(2-methylsulfanylethyl)piperazine-1-carboxylate.
Chemical Property Profile of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester
Property Insights of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester
The XLogP value of 1.1235 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester. With a topological polar surface area (TPSA) of 32.78 Ų, 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester 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-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester?
The CAS number of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester is 88708-36-5.
What is the molecular formula of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester?
The molecular formula of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester is C10H20N2O2S.
What is the molecular weight of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester?
The molecular weight of 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester is 232.12 g/mol.
Where can I buy 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester?
You can request a quote for 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarboxylic acid, 4-[2-(methylthio)ethyl]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.