2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium
TL;DR: 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium (CAS 55911-28-9) is a chemical compound with molecular formula C19H19N2O4S+ and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-methoxy-1-benzofuran-2-yl)-1,3-dimethyl-5-methylsulfonylbenzimidazol-1-ium
Also Known As: 1,3-Dimethyl-2-(6-methoxybenzofuran-2-yl)-5-methylsulfonyl-1H-benzimidazol-3-ium, 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium, 2-(6-methoxybenzofuran-2-yl)-1,3-dimethyl-5-methylsulfonyl-benzoimidazole, 1,3-Dimethyl-2-(6-methoxybenzofuran-2-yl)-5-(methylsulfonyl)-1H-benzimidazole-3-ium, 2-(6-methoxy-1-benzofuran-2-yl)-1,3-dimethyl-5-methylsulfonylbenzimidazol-1-ium
| Molecular Formula | C19H19N2O4S+ |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.10657 |
| Heavy Atoms | 26 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 55911-28-9 |
|---|---|
| SMILES | CN1C2=C(C=CC(=C2)S(=O)(=O)C)[N+](=C1C3=CC4=C(O3)C=C(C=C4)OC)C |
| InChIKey | NGWGVNKWZALWFL-UHFFFAOYSA-N |
Product Overview
2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium (CAS 55911-28-9), with molecular formula C19H19N2O4S+ and molecular weight 371.11 g/mol. IUPAC: 2-(6-methoxy-1-benzofuran-2-yl)-1,3-dimethyl-5-methylsulfonylbenzimidazol-1-ium.
Chemical Property Profile of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium
Property Insights of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium. Following Lipinski's Rule of Five, 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium has 0 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 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium?
The CAS number of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium is 55911-28-9.
What is the molecular formula of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium?
The molecular formula of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium is C19H19N2O4S+.
What is the molecular weight of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium?
The molecular weight of 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium is 371.11 g/mol.
Where can I buy 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium?
You can request a quote for 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium?
Yes, KEHONG BIO provides custom synthesis services for 2-(6-Methoxy-2-benzofuranyl)-1,3-dimethyl-5-(methylsulfonyl)-1H-benzimidazolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.