2-Benzylthiobenzimidazole
TL;DR: 2-Benzylthiobenzimidazole (CAS 51290-77-8) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-1H-benzimidazole
Also Known As: 2-(BENZYLTHIO)-1H-BENZIMIDAZOLE, 2-(benzylthio)-1H-benzo[d]imidazole, 2-benzylsulfanyl-1H-benzimidazole, 2-benzylthiobenzimidazole, 2-(Benzylthio)benzimidazole
| Molecular Formula | C14H12N2S |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.07211 |
| Heavy Atoms | 17 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 51290-77-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2 |
| InChIKey | IJINDUSMSVDESS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Benzylthiobenzimidazole (CAS 51290-77-8), with molecular formula C14H12N2S and molecular weight 240.07 g/mol. IUPAC: 2-benzylsulfanyl-1H-benzimidazole.
Chemical Property Profile of 2-Benzylthiobenzimidazole
Property Insights of 2-Benzylthiobenzimidazole
The XLogP value of 3.6 indicates that 2-Benzylthiobenzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 2-Benzylthiobenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzylthiobenzimidazole 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-Benzylthiobenzimidazole?
The CAS number of 2-Benzylthiobenzimidazole is 51290-77-8.
What is the molecular formula of 2-Benzylthiobenzimidazole?
The molecular formula of 2-Benzylthiobenzimidazole is C14H12N2S.
What is the molecular weight of 2-Benzylthiobenzimidazole?
The molecular weight of 2-Benzylthiobenzimidazole is 240.07 g/mol.
Where can I buy 2-Benzylthiobenzimidazole?
You can request a quote for 2-Benzylthiobenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzylthiobenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylthiobenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.