2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone
TL;DR: 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone (CAS 57338-59-7) is a chemical compound with molecular formula C12H9BrClN3O3 and molecular weight 356.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(4-chlorophenyl)ethanone
Also Known As: J1.077.102A, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-(4-chlorophenyl)ethanone, 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone, 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(4-chlorophenyl)ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-(4-chlorophenyl)ethan-1-one
| Molecular Formula | C12H9BrClN3O3 |
|---|---|
| Molecular Weight | 356.95 g/mol |
| LogP | 3.39852 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.95157 |
| Heavy Atoms | 20 |
| Complexity | 682.00116 |
Chemical Identifiers
| CAS Number | 57338-59-7 |
|---|---|
| SMILES | CC1=NC(=C(N1CC(=O)C2=CC=C(C=C2)Cl)Br)[N+](=O)[O-] |
Product Overview
2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone (CAS 57338-59-7), with molecular formula C12H9BrClN3O3 and molecular weight 356.95 g/mol. IUPAC: 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(4-chlorophenyl)ethanone.
Chemical Property Profile of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone
Property Insights of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone
The XLogP value of 3.39852 indicates that 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone. Following Lipinski's Rule of Five, 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone has 0 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 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone?
The CAS number of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone is 57338-59-7.
What is the molecular formula of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone?
The molecular formula of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone is C12H9BrClN3O3.
What is the molecular weight of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone?
The molecular weight of 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone is 356.95 g/mol.
Where can I buy 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone?
You can request a quote for 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-chloro-phenyl)-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.