Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-
TL;DR: Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- (CAS 3393-60-0) is a chemical compound with molecular formula C8H2Br3F3N2 and molecular weight 419.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,7-tribromo-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-, 4,5,7-Tribromo-2-(trifluoromethyl)benzimidazole, 4,5,7-Tribromo-2-(trifluoromethyl)-1H-benzimidazole, 4,6,7-tribromo-2-(trifluoromethyl)-1H-benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-1H-1,3-benzodiazole
| Molecular Formula | C8H2Br3F3N2 |
|---|---|
| Molecular Weight | 419.77 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 419.77203 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 3393-60-0 |
|---|---|
| SMILES | C1=C(C2=C(C(=C1Br)Br)NC(=N2)C(F)(F)F)Br |
| InChIKey | GYDGKROMMMZLQI-UHFFFAOYSA-N |
Product Overview
Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- (CAS 3393-60-0), with molecular formula C8H2Br3F3N2 and molecular weight 419.77 g/mol. IUPAC: 4,6,7-tribromo-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-
Property Insights of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-
The XLogP value of 4.1 indicates that Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- 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 Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-?
The CAS number of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- is 3393-60-0.
What is the molecular formula of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-?
The molecular formula of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- is C8H2Br3F3N2.
What is the molecular weight of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-?
The molecular weight of Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- is 419.77 g/mol.
Where can I buy Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-?
You can request a quote for Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 4,5,7-tribromo-2-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.