![1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole structure](/static/products/3282/328243-83-0.webp)
1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole
TL;DR: 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole (CAS 328243-83-0) is a chemical compound with molecular formula C11H9ClFN3O2 and molecular weight 269.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole
Also Known As: BAS 08840722, 1-(2-chloro-6-fluorobenzyl)-2-methyl-5-nitro-1H-imidazole, 1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole, 1-(2-Chloro-6-fluoro-benzyl)-2-methyl-5-nitro-1H-imidazole, 1-[(6-chloro-2-fluorophenyl)methyl]-2-methyl-5-nitroimidazole
| Molecular Formula | C11H9ClFN3O2 |
|---|---|
| Molecular Weight | 269.04 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.03674 |
| Heavy Atoms | 18 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 328243-83-0 |
|---|---|
| SMILES | CC1=NC=C(N1CC2=C(C=CC=C2Cl)F)[N+](=O)[O-] |
| InChIKey | VCOKVGYYZVUPED-UHFFFAOYSA-N |
Product Overview
1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole (CAS 328243-83-0), with molecular formula C11H9ClFN3O2 and molecular weight 269.04 g/mol. IUPAC: 1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole.
Chemical Property Profile of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole
Property Insights of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole. Following Lipinski's Rule of Five, 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole 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 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole?
The CAS number of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole is 328243-83-0.
What is the molecular formula of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole?
The molecular formula of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole is C11H9ClFN3O2.
What is the molecular weight of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole?
The molecular weight of 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole is 269.04 g/mol.
Where can I buy 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole?
You can request a quote for 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Chloro-6-fluorophenyl)methyl]-2-methyl-5-nitroimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.