3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione
TL;DR: 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione (CAS 41670-36-4) is a chemical compound with molecular formula C10H18N2O2S2 and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-bis(2-methylsulfanylethyl)piperazine-2,5-dione
Also Known As: Cyclo-dimethionine, Cyclo(dimethionine), Cyclo(-Met-Met), Cyclo(LL-dimethionine), 3,6-bis[2-(Methylthio)ethyl]piperazine-2,5-dione
| Molecular Formula | C10H18N2O2S2 |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 262.08096 |
| Heavy Atoms | 16 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 41670-36-4 |
|---|---|
| SMILES | CSCCC1C(=O)NC(C(=O)N1)CCSC |
| InChIKey | VSOISORJHNBTCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione (CAS 41670-36-4), with molecular formula C10H18N2O2S2 and molecular weight 262.08 g/mol. IUPAC: 3,6-bis(2-methylsulfanylethyl)piperazine-2,5-dione.
Chemical Property Profile of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione
Property Insights of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione. Following Lipinski's Rule of Five, 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione has 2 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 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione?
The CAS number of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione is 41670-36-4.
What is the molecular formula of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione?
The molecular formula of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione is C10H18N2O2S2.
What is the molecular weight of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione?
The molecular weight of 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione is 262.08 g/mol.
Where can I buy 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione?
You can request a quote for 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Bis(2-(methylthio)ethyl)-2,5-piperazinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.