7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine
TL;DR: 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine (CAS 84201-40-1) is a chemical compound with molecular formula C10H12N2S2 and molecular weight 224.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-6,8-bis(methylsulfanyl)pyrrolo[1,2-a]pyrazine
Also Known As: Mbmtpp, Metabolite III, Oltipraz metabolite M2, MIII, 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine
| Molecular Formula | C10H12N2S2 |
|---|---|
| Molecular Weight | 224.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.04419 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 84201-40-1 |
|---|---|
| SMILES | CC1=C(N2C=CN=CC2=C1SC)SC |
| InChIKey | MYLBTCQBKAKUTJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine (CAS 84201-40-1), with molecular formula C10H12N2S2 and molecular weight 224.04 g/mol. IUPAC: 7-methyl-6,8-bis(methylsulfanyl)pyrrolo[1,2-a]pyrazine.
Chemical Property Profile of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine
Property Insights of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine
The XLogP value of 3.1 indicates that 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine. Following Lipinski's Rule of Five, 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine has 0 hydrogen bond donor(s) and 3 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 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine?
The CAS number of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine is 84201-40-1.
What is the molecular formula of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine?
The molecular formula of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine is C10H12N2S2.
What is the molecular weight of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine?
The molecular weight of 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine is 224.04 g/mol.
Where can I buy 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine?
You can request a quote for 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine?
Yes, KEHONG BIO provides custom synthesis services for 7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.