5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole
TL;DR: 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole (CAS 113608-77-8) is a chemical compound with molecular formula C11H6N4O5 and molecular weight 274.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-2-(5-nitrofuran-2-yl)-1H-benzimidazole
Also Known As: 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole, 5-nitro-2-(5-nitrofur-2-yl)benzimidazole, 2-nitro-5-(5-nitrobenzimidazol-2-yl)furan, 5-nitro-2-(5-nitrofuran-2-yl)-1H-benzimidazole, 5-Nitro-2-(5-nitrofuran-2-yl)-1H-benzo[d]imidazole
| Molecular Formula | C11H6N4O5 |
|---|---|
| Molecular Weight | 274.03 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.0338 |
| Heavy Atoms | 20 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 113608-77-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | QZARPLILBWVJRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole (CAS 113608-77-8), with molecular formula C11H6N4O5 and molecular weight 274.03 g/mol. IUPAC: 6-nitro-2-(5-nitrofuran-2-yl)-1H-benzimidazole.
Chemical Property Profile of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole
Property Insights of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole. Following Lipinski's Rule of Five, 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole has 1 hydrogen bond donor(s) and 6 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 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole?
The CAS number of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole is 113608-77-8.
What is the molecular formula of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole?
The molecular formula of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole is C11H6N4O5.
What is the molecular weight of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole?
The molecular weight of 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole is 274.03 g/mol.
Where can I buy 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole?
You can request a quote for 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-2-(5-nitro-furan-2-yl)-1H-benzoimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.