5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol
TL;DR: 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol (CAS 68828-69-3) is a chemical compound with molecular formula C13H7Cl3N2OS and molecular weight 343.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-(2,3-dichlorophenoxy)-1,3-dihydrobenzimidazole-2-thione
Also Known As: Triclabendazole EP Impurity B, Triclabendazole Impurity 3, TRICLABENDAZOLE METABOLITE M8, 5-chloro-6-(2,3-dichorophenoxy)-2-thio-1H-benzimidazole, 5-Chloro-6-(2,3-dichlorophenoxy)-1,3-dihydro-2H-benzo[d]imidazole-2-thione
| Molecular Formula | C13H7Cl3N2OS |
|---|---|
| Molecular Weight | 343.93 g/mol |
| LogP | 5.97799 |
| Topological Polar Surface Area | 40.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.93448 |
| Heavy Atoms | 20 |
| Complexity | 856.43384 |
Chemical Identifiers
| CAS Number | 68828-69-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)OC2=C(C=C3C(=C2)NC(=S)N3)Cl |
Product Overview
5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol (CAS 68828-69-3), with molecular formula C13H7Cl3N2OS and molecular weight 343.93 g/mol. IUPAC: 5-chloro-6-(2,3-dichlorophenoxy)-1,3-dihydrobenzimidazole-2-thione.
Chemical Property Profile of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol
Property Insights of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol
The XLogP value of 5.97799 indicates that 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.81 Ų, 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol?
The CAS number of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol is 68828-69-3.
What is the molecular formula of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol?
The molecular formula of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol is C13H7Cl3N2OS.
What is the molecular weight of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol?
The molecular weight of 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol is 343.93 g/mol.
Where can I buy 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol?
You can request a quote for 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-6-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.