N-Methylsulfonylimidazole
TL;DR: N-Methylsulfonylimidazole (CAS 58520-04-0) 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.
1-methylsulfonylimidazole
Also Known As: N-Methanesulfonylimidazole, 1-methylsulfonylimidazole, 1-(Methylsulfonyl)-1H-imidazole, 1-Mesylimidazole, N-Methylsulfonylimidazole
| Molecular Formula | C4H6N2O2S |
|---|---|
| Molecular Weight | 146.01 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 146.015 |
| Heavy Atoms | 9 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 58520-04-0 |
|---|---|
| SMILES | CS(=O)(=O)N1C=CN=C1 |
| InChIKey | ZBHRCOWHFHJZFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methylsulfonylimidazole (CAS 58520-04-0), with molecular formula C4H6N2O2S and molecular weight 146.01 g/mol. IUPAC: 1-methylsulfonylimidazole.
Chemical Property Profile of N-Methylsulfonylimidazole
Property Insights of N-Methylsulfonylimidazole
The XLogP value of -0.3 indicates that N-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 N-Methylsulfonylimidazole. Following Lipinski's Rule of Five, N-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 N-Methylsulfonylimidazole?
The CAS number of N-Methylsulfonylimidazole is 58520-04-0.
What is the molecular formula of N-Methylsulfonylimidazole?
The molecular formula of N-Methylsulfonylimidazole is C4H6N2O2S.
What is the molecular weight of N-Methylsulfonylimidazole?
The molecular weight of N-Methylsulfonylimidazole is 146.01 g/mol.
Where can I buy N-Methylsulfonylimidazole?
You can request a quote for N-Methylsulfonylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylsulfonylimidazole?
Yes, KEHONG BIO provides custom synthesis services for N-Methylsulfonylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.