1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole
TL;DR: 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole (CAS 488715-69-1) is a chemical compound with molecular formula C13H15F3N2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylbutyl)-2-(trifluoromethyl)benzimidazole
Also Known As: 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole, 1-(3-methylbutyl)-2-(trifluoromethyl)benzimidazole, 1-(3-methylbutyl)-2-(trifluoromethyl)benzoimidazole, 1-isopentyl-2-(trifluoromethyl)-1H-benzo[d]imidazole
| Molecular Formula | C13H15F3N2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 4.1012 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.11874 |
| Heavy Atoms | 18 |
| Complexity | 540.6502 |
Chemical Identifiers
| CAS Number | 488715-69-1 |
|---|---|
| SMILES | CC(C)CCN1C2=CC=CC=C2N=C1C(F)(F)F |
Product Overview
1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole (CAS 488715-69-1), with molecular formula C13H15F3N2 and molecular weight 256.12 g/mol. IUPAC: 1-(3-methylbutyl)-2-(trifluoromethyl)benzimidazole.
Chemical Property Profile of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole
Property Insights of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole
The XLogP value of 4.1012 indicates that 1-(3-methylbutyl)-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 17.82 Ų, 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole has 0 hydrogen bond donor(s) and 1 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 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole?
The CAS number of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole is 488715-69-1.
What is the molecular formula of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole?
The molecular formula of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole is C13H15F3N2.
What is the molecular weight of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole?
The molecular weight of 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole is 256.12 g/mol.
Where can I buy 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole?
You can request a quote for 1-(3-methylbutyl)-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 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-methylbutyl)-2-(trifluoromethyl)-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.