5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole
TL;DR: 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole (CAS 2338-27-4) is a chemical compound with molecular formula C8H2Cl3F3N2 and molecular weight 287.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6-trichloro-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: Benzimidazole, 4,5,6-trichloro-2-(trifluoromethyl)-, NC 2786, 4,5,6-trichloro-2-(trifluoromethyl)-1h-benzimidazole, trichloro 2-trifluoromethyl-benzimidazole, 4,5,6-Trichloro-2-(trifluoromethyl)benzimidazole
| Molecular Formula | C8H2Cl3F3N2 |
|---|---|
| Molecular Weight | 287.92 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.92355 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 2338-27-4 |
|---|---|
| SMILES | C1=C2C(=C(C(=C1Cl)Cl)Cl)N=C(N2)C(F)(F)F |
| InChIKey | BXCSXZJKEJQDKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole (CAS 2338-27-4), with molecular formula C8H2Cl3F3N2 and molecular weight 287.92 g/mol. IUPAC: 4,5,6-trichloro-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole
Property Insights of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole
The XLogP value of 3.9 indicates that 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,7-Trichloro-2-(trifluoromethyl)-1H-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 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole?
The CAS number of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole is 2338-27-4.
What is the molecular formula of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole?
The molecular formula of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole is C8H2Cl3F3N2.
What is the molecular weight of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole?
The molecular weight of 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole is 287.92 g/mol.
Where can I buy 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole?
You can request a quote for 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7-Trichloro-2-(trifluoromethyl)-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.