1-Methyl-2-methylsulfonylimidazole
TL;DR: 1-Methyl-2-methylsulfonylimidazole (CAS 71691-71-9) is a chemical compound with molecular formula C5H8N2O2S and molecular weight 160.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-methylsulfonylimidazole
Also Known As: 1-methyl-2-methylsulfonylimidazole, 1-Methyl-2-(methylsulfonyl)-1H-imidazole, 2-methanesulfonyl-1-methyl-imidazole, 1-methyl-2-methylsulfonyl-imidazole, 1H-Imidazole, 1-methyl-2-(methylsulfonyl)-
| Molecular Formula | C5H8N2O2S |
|---|---|
| Molecular Weight | 160.03 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.03065 |
| Heavy Atoms | 10 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 71691-71-9 |
|---|---|
| SMILES | CN1C=CN=C1S(=O)(=O)C |
| InChIKey | GXMPTOIKNNBAAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-2-methylsulfonylimidazole (CAS 71691-71-9), with molecular formula C5H8N2O2S and molecular weight 160.03 g/mol. IUPAC: 1-methyl-2-methylsulfonylimidazole.
Chemical Property Profile of 1-Methyl-2-methylsulfonylimidazole
Property Insights of 1-Methyl-2-methylsulfonylimidazole
The XLogP value of -0.4 indicates that 1-Methyl-2-methylsulfonylimidazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-2-methylsulfonylimidazole. Following Lipinski's Rule of Five, 1-Methyl-2-methylsulfonylimidazole 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 1-Methyl-2-methylsulfonylimidazole?
The CAS number of 1-Methyl-2-methylsulfonylimidazole is 71691-71-9.
What is the molecular formula of 1-Methyl-2-methylsulfonylimidazole?
The molecular formula of 1-Methyl-2-methylsulfonylimidazole is C5H8N2O2S.
What is the molecular weight of 1-Methyl-2-methylsulfonylimidazole?
The molecular weight of 1-Methyl-2-methylsulfonylimidazole is 160.03 g/mol.
Where can I buy 1-Methyl-2-methylsulfonylimidazole?
You can request a quote for 1-Methyl-2-methylsulfonylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-methylsulfonylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-methylsulfonylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.