1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole
TL;DR: 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole (CAS 68019-63-6) is a chemical compound with molecular formula C10H8FN3O2 and molecular weight 221.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-4-nitroimidazole
Also Known As: 1-[(4-fluorophenyl)methyl]-4-nitro-1H-imidazole, 1-(4-fluorobenzyl)-4-nitro-1H-imidazole, 1-[(4-fluorophenyl)methyl]-4-nitroimidazole, BAS 00288637, 1-(4-Fluoro-benzyl)-4-nitro-1H-imidazole
| Molecular Formula | C10H8FN3O2 |
|---|---|
| Molecular Weight | 221.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.06006 |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 68019-63-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=C(N=C2)[N+](=O)[O-])F |
| InChIKey | LLBADCKDSZVYBL-UHFFFAOYSA-N |
Product Overview
1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole (CAS 68019-63-6), with molecular formula C10H8FN3O2 and molecular weight 221.06 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-4-nitroimidazole.
Chemical Property Profile of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole
Property Insights of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole. Following Lipinski's Rule of Five, 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole 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-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole?
The CAS number of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole is 68019-63-6.
What is the molecular formula of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole?
The molecular formula of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole is C10H8FN3O2.
What is the molecular weight of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole?
The molecular weight of 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole is 221.06 g/mol.
Where can I buy 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole?
You can request a quote for 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-((4-fluorophenyl)methyl)-4-nitro-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.