4,5,6,7-四氯-2-三氟甲基苯并咪唑
TL;DR: 4,5,6,7-四氯-2-三氟甲基苯并咪唑 (CAS 2338-29-6) is a chemical compound with molecular formula C8HCl4F3N2 and molecular weight 321.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7-四氯-2-三氟甲基苯并咪唑
4,5,6,7-tetrachloro-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: TTFB, 4,5,6,7-Tetrachloro-2-trifluoromethylbenzimidazole, C8HCl4F3N2, 4,5,6,7-tetrachloro-2-(trifluoromethyl)-1H-benzimidazole, Tetrachlorotrifluoromethylbenzimidazole
| Molecular Formula | C8HCl4F3N2 |
|---|---|
| Molecular Weight | 321.88 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 323.88165 |
| Heavy Atoms | 17 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 2338-29-6 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)N=C(N2)C(F)(F)F |
| InChIKey | QLKDMIUEWFNEPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5,6,7-四氯-2-三氟甲基苯并咪唑 (CAS 2338-29-6), with molecular formula C8HCl4F3N2 and molecular weight 321.88 g/mol. IUPAC: 4,5,6,7-tetrachloro-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of 4,5,6,7-四氯-2-三氟甲基苯并咪唑
Property Insights of 4,5,6,7-四氯-2-三氟甲基苯并咪唑
The XLogP value of 4.4 indicates that 4,5,6,7-四氯-2-三氟甲基苯并咪唑 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 4,5,6,7-四氯-2-三氟甲基苯并咪唑 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-四氯-2-三氟甲基苯并咪唑 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 4,5,6,7-四氯-2-三氟甲基苯并咪唑?
The CAS number of 4,5,6,7-四氯-2-三氟甲基苯并咪唑 is 2338-29-6.
What is the molecular formula of 4,5,6,7-四氯-2-三氟甲基苯并咪唑?
The molecular formula of 4,5,6,7-四氯-2-三氟甲基苯并咪唑 is C8HCl4F3N2.
What is the molecular weight of 4,5,6,7-四氯-2-三氟甲基苯并咪唑?
The molecular weight of 4,5,6,7-四氯-2-三氟甲基苯并咪唑 is 321.88 g/mol.
Where can I buy 4,5,6,7-四氯-2-三氟甲基苯并咪唑?
You can request a quote for 4,5,6,7-四氯-2-三氟甲基苯并咪唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7-四氯-2-三氟甲基苯并咪唑?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-四氯-2-三氟甲基苯并咪唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.