Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate
TL;DR: Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate (CAS 882215-65-8) is a chemical compound with molecular formula C22H21N5O3 and molecular weight 403.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[2-(5-acetamido-3-methylpyrazol-1-yl)benzimidazol-1-yl]methyl]benzoate
Also Known As: Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate, methyl 4-[[2-(5-acetamido-3-methylpyrazol-1-yl)benzimidazol-1-yl]methyl]benzoate, methyl 4-((2-(5-acetamido-3-methyl-1H-pyrazol-1-yl)-1H-benzo[d]imidazol-1-yl)methyl)benzoate, methyl 4-({2-[5-(acetylamino)-3-methyl-1H-pyrazol-1-yl]-1H-benzimidazol-1-yl}methyl)benzoate
| Molecular Formula | C22H21N5O3 |
|---|---|
| Molecular Weight | 403.16 g/mol |
| LogP | 3.32372 |
| Topological Polar Surface Area | 91.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.16443 |
| Heavy Atoms | 30 |
| Complexity | 1237.637 |
Chemical Identifiers
| CAS Number | 882215-65-8 |
|---|---|
| SMILES | CC1=NN(C(=C1)NC(=O)C)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C(=O)OC |
Product Overview
Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate (CAS 882215-65-8), with molecular formula C22H21N5O3 and molecular weight 403.16 g/mol. IUPAC: methyl 4-[[2-(5-acetamido-3-methylpyrazol-1-yl)benzimidazol-1-yl]methyl]benzoate.
Chemical Property Profile of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate
Property Insights of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate
The XLogP value of 3.32372 indicates that Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.04 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate. Following Lipinski's Rule of Five, Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate has 1 hydrogen bond donor(s) and 5 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 Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate?
The CAS number of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate is 882215-65-8.
What is the molecular formula of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate?
The molecular formula of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate is C22H21N5O3.
What is the molecular weight of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate?
The molecular weight of Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate is 403.16 g/mol.
Where can I buy Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate?
You can request a quote for Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[[2-(5-acetamido-3-methyl-pyrazol-1-yl)benzoimidazol-1-yl]methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.