ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate
TL;DR: ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate (CAS 433254-85-4) is a chemical compound with molecular formula C19H16F3N3O3 and molecular weight 391.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[2-(trifluoromethyl)benzimidazol-1-yl]acetyl]amino]benzoate
Also Known As: CBKinase1_002173, CBKinase1_014573, BRD-K85886532-001-01-0, A2898/0122061, ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate
| Molecular Formula | C19H16F3N3O3 |
|---|---|
| Molecular Weight | 391.11 g/mol |
| LogP | 3.8705 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.11438 |
| Heavy Atoms | 28 |
| Complexity | 1010.676 |
Chemical Identifiers
| CAS Number | 433254-85-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2C(F)(F)F |
Product Overview
ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate (CAS 433254-85-4), with molecular formula C19H16F3N3O3 and molecular weight 391.11 g/mol. IUPAC: ethyl 4-[[2-[2-(trifluoromethyl)benzimidazol-1-yl]acetyl]amino]benzoate.
Chemical Property Profile of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate
Property Insights of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate
The XLogP value of 3.8705 indicates that ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate. Following Lipinski's Rule of Five, ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate 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 ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate?
The CAS number of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate is 433254-85-4.
What is the molecular formula of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate?
The molecular formula of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate is C19H16F3N3O3.
What is the molecular weight of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate?
The molecular weight of ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate is 391.11 g/mol.
Where can I buy ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate?
You can request a quote for ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-({[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.