5,6-Diethoxy-2-(methyl-thio)-benzimidazole
TL;DR: 5,6-Diethoxy-2-(methyl-thio)-benzimidazole (CAS 201055-79-0) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-diethoxy-2-methylsulfanyl-1H-benzimidazole
Also Known As: 5,6-diethoxy-2-(methyl-thio)-benzimidazole, 5,6-diethoxy-2-methylsulfanyl-1H-benzimidazole, 5,6-diethoxy-2-methylsulfanyl-1H-benzoimidazole, 5,6-diethoxy-2-(methylthio)-1H-benzo[d]imidazole
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 3.0822 |
| Topological Polar Surface Area | 47.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 467.4201 |
Chemical Identifiers
| CAS Number | 201055-79-0 |
|---|---|
| SMILES | CCOC1=C(C=C2C(=C1)NC(=N2)SC)OCC |
Product Overview
5,6-Diethoxy-2-(methyl-thio)-benzimidazole (CAS 201055-79-0), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: 5,6-diethoxy-2-methylsulfanyl-1H-benzimidazole.
Chemical Property Profile of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole
Property Insights of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole
The XLogP value of 3.0822 indicates that 5,6-Diethoxy-2-(methyl-thio)-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.14 Ų, 5,6-Diethoxy-2-(methyl-thio)-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Diethoxy-2-(methyl-thio)-benzimidazole has 1 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 5,6-Diethoxy-2-(methyl-thio)-benzimidazole?
The CAS number of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole is 201055-79-0.
What is the molecular formula of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole?
The molecular formula of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole is C12H16N2O2S.
What is the molecular weight of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole?
The molecular weight of 5,6-Diethoxy-2-(methyl-thio)-benzimidazole is 252.09 g/mol.
Where can I buy 5,6-Diethoxy-2-(methyl-thio)-benzimidazole?
You can request a quote for 5,6-Diethoxy-2-(methyl-thio)-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Diethoxy-2-(methyl-thio)-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Diethoxy-2-(methyl-thio)-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.