1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole
TL;DR: 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole (CAS 82603-41-6) is a chemical compound with molecular formula C10H7N5O6 and molecular weight 293.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dinitrophenyl)-2-methyl-5-nitroimidazole
Also Known As: 1-(2,4-dinitrophenyl)-2-methyl-5-nitroimidazole, 1-(2,4-dinitrophenyl)-2-methyl-5-nitro-imidazole, 1-(2,4-Dinitrophenyl)-2-methyl-5-nitro-1H-imidazole
| Molecular Formula | C10H7N5O6 |
|---|---|
| Molecular Weight | 293.04 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 293.03964 |
| Heavy Atoms | 21 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 82603-41-6 |
|---|---|
| SMILES | CC1=NC=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CKUHQYAVNYLAEA-UHFFFAOYSA-N |
Product Overview
1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole (CAS 82603-41-6), with molecular formula C10H7N5O6 and molecular weight 293.04 g/mol. IUPAC: 1-(2,4-dinitrophenyl)-2-methyl-5-nitroimidazole.
Chemical Property Profile of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole
Property Insights of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole. The TPSA of 155.0 Ų indicates high polarity, suggesting 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole has 0 hydrogen bond donor(s) and 7 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-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole?
The CAS number of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole is 82603-41-6.
What is the molecular formula of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole?
The molecular formula of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole is C10H7N5O6.
What is the molecular weight of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole?
The molecular weight of 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole is 293.04 g/mol.
Where can I buy 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole?
You can request a quote for 1-(2,4-Dinitrophenyl)-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-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dinitrophenyl)-2-methyl-5-nitroimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.