2-(Methylsulfonyl)imidazole
TL;DR: 2-(Methylsulfonyl)imidazole (CAS 27098-98-2) is a chemical compound with molecular formula C4H6N2O2S and molecular weight 146.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfonyl-1H-imidazole
Also Known As: 2-(Methylsulfonyl)imidazole, 2-methanesulfonyl-1H-imidazole, 2-Methylsulfonyl-imidazole, 2-methylsulfonyl-1H-imidazole, 2-mesyl-imidazole
| Molecular Formula | C4H6N2O2S |
|---|---|
| Molecular Weight | 146.01 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 71.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 146.015 |
| Heavy Atoms | 9 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 27098-98-2 |
|---|---|
| SMILES | CS(=O)(=O)C1=NC=CN1 |
| InChIKey | YNKRJGZPPAUPLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Methylsulfonyl)imidazole (CAS 27098-98-2), with molecular formula C4H6N2O2S and molecular weight 146.01 g/mol. IUPAC: 2-methylsulfonyl-1H-imidazole.
Chemical Property Profile of 2-(Methylsulfonyl)imidazole
Property Insights of 2-(Methylsulfonyl)imidazole
The XLogP value of -0.4 indicates that 2-(Methylsulfonyl)imidazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methylsulfonyl)imidazole. Following Lipinski's Rule of Five, 2-(Methylsulfonyl)imidazole has 1 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 2-(Methylsulfonyl)imidazole?
The CAS number of 2-(Methylsulfonyl)imidazole is 27098-98-2.
What is the molecular formula of 2-(Methylsulfonyl)imidazole?
The molecular formula of 2-(Methylsulfonyl)imidazole is C4H6N2O2S.
What is the molecular weight of 2-(Methylsulfonyl)imidazole?
The molecular weight of 2-(Methylsulfonyl)imidazole is 146.01 g/mol.
Where can I buy 2-(Methylsulfonyl)imidazole?
You can request a quote for 2-(Methylsulfonyl)imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylsulfonyl)imidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylsulfonyl)imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.