![3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone structure](/static/products/4780/478030-27-2.webp)
3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone
TL;DR: 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone (CAS 478030-27-2) is a chemical compound with molecular formula C14H15F3N2O and molecular weight 284.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1-[2-(trifluoromethyl)benzimidazol-1-yl]butan-2-one
Also Known As: 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone, 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]butan-2-one, 3,3-dimethyl-1-[2-(trifluoromethyl)benzimidazol-1-yl]butan-2-one, 2R-1511, 3,3-dimethyl-1-[2-(trifluoromethyl)-1,3-benzodiazol-1-yl]butan-2-one
| Molecular Formula | C14H15F3N2O |
|---|---|
| Molecular Weight | 284.11 g/mol |
| LogP | 3.6703 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.11365 |
| Heavy Atoms | 20 |
| Complexity | 650.46326 |
Chemical Identifiers
| CAS Number | 478030-27-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1C(F)(F)F |
Product Overview
3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone (CAS 478030-27-2), with molecular formula C14H15F3N2O and molecular weight 284.11 g/mol. IUPAC: 3,3-dimethyl-1-[2-(trifluoromethyl)benzimidazol-1-yl]butan-2-one.
Chemical Property Profile of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone
Property Insights of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone
The XLogP value of 3.6703 indicates that 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone has 0 hydrogen bond donor(s) and 2 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 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone?
The CAS number of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone is 478030-27-2.
What is the molecular formula of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone?
The molecular formula of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone is C14H15F3N2O.
What is the molecular weight of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone?
The molecular weight of 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone is 284.11 g/mol.
Where can I buy 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone?
You can request a quote for 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone?
Yes, KEHONG BIO provides custom synthesis services for 3,3-dimethyl-1-[2-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]-2-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.