2-(Methylthio)benzimidazole
TL;DR: 2-(Methylthio)benzimidazole (CAS 7152-24-1) is a chemical compound with molecular formula C8H8N2S and molecular weight 164.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-1H-benzimidazole
Also Known As: 2-(Methylthio)benzimidazole, 2-Methylmercaptobenzimidazole, 2-(methylthio)-1H-benzo[d]imidazole, 1H-Benzimidazole, 2-(methylthio)-, 2-methylthiobenzimidazole
| Molecular Formula | C8H8N2S |
|---|---|
| Molecular Weight | 164.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.04082 |
| Heavy Atoms | 11 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 7152-24-1 |
|---|---|
| SMILES | CSC1=NC2=CC=CC=C2N1 |
| InChIKey | OCKJFOHZLXIAAT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Methylthio)benzimidazole (CAS 7152-24-1), with molecular formula C8H8N2S and molecular weight 164.04 g/mol. IUPAC: 2-methylsulfanyl-1H-benzimidazole.
Chemical Property Profile of 2-(Methylthio)benzimidazole
Property Insights of 2-(Methylthio)benzimidazole
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylthio)benzimidazole. With a topological polar surface area (TPSA) of 54.0 Ų, 2-(Methylthio)benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylthio)benzimidazole has 1 hydrogen bond donor(s) and 2 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-(Methylthio)benzimidazole?
The CAS number of 2-(Methylthio)benzimidazole is 7152-24-1.
What is the molecular formula of 2-(Methylthio)benzimidazole?
The molecular formula of 2-(Methylthio)benzimidazole is C8H8N2S.
What is the molecular weight of 2-(Methylthio)benzimidazole?
The molecular weight of 2-(Methylthio)benzimidazole is 164.04 g/mol.
Where can I buy 2-(Methylthio)benzimidazole?
You can request a quote for 2-(Methylthio)benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylthio)benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylthio)benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.