Imidazole, 2-(4-nitrophenyl)-4-nitro-
TL;DR: Imidazole, 2-(4-nitrophenyl)-4-nitro- (CAS 4205-17-8) is a chemical compound with molecular formula C9H6N4O4 and molecular weight 234.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-(4-nitrophenyl)-1H-imidazole
Also Known As: D-Gulose, Imidazole, 2-(4-nitrophenyl)-4-nitro-, 5-nitro-2-(4-nitrophenyl)-1H-imidazole, 2-(4-Nitrophenyl)-4-nitro-1H-imidazole, 2-p-Nitrophenyl-4-nitroimidazol
| Molecular Formula | C9H6N4O4 |
|---|---|
| Molecular Weight | 234.04 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.03891 |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 4205-17-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC=C(N2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AKBWSCCZQFYAFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Imidazole, 2-(4-nitrophenyl)-4-nitro- (CAS 4205-17-8), with molecular formula C9H6N4O4 and molecular weight 234.04 g/mol. IUPAC: 5-nitro-2-(4-nitrophenyl)-1H-imidazole.
Chemical Property Profile of Imidazole, 2-(4-nitrophenyl)-4-nitro-
Property Insights of Imidazole, 2-(4-nitrophenyl)-4-nitro-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole, 2-(4-nitrophenyl)-4-nitro-. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazole, 2-(4-nitrophenyl)-4-nitro-. Following Lipinski's Rule of Five, Imidazole, 2-(4-nitrophenyl)-4-nitro- 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 Imidazole, 2-(4-nitrophenyl)-4-nitro-?
The CAS number of Imidazole, 2-(4-nitrophenyl)-4-nitro- is 4205-17-8.
What is the molecular formula of Imidazole, 2-(4-nitrophenyl)-4-nitro-?
The molecular formula of Imidazole, 2-(4-nitrophenyl)-4-nitro- is C9H6N4O4.
What is the molecular weight of Imidazole, 2-(4-nitrophenyl)-4-nitro-?
The molecular weight of Imidazole, 2-(4-nitrophenyl)-4-nitro- is 234.04 g/mol.
Where can I buy Imidazole, 2-(4-nitrophenyl)-4-nitro-?
You can request a quote for Imidazole, 2-(4-nitrophenyl)-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole, 2-(4-nitrophenyl)-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Imidazole, 2-(4-nitrophenyl)-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.