1H-Benzimidazole, 2-(5-nitro-2-furanyl)-
TL;DR: 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- (CAS 3945-78-6) is a chemical compound with molecular formula C11H7N3O3 and molecular weight 229.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-nitrofuran-2-yl)-1H-benzimidazole
Also Known As: 2-(5-nitrofuran-2-yl)-1H-benzimidazole, 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-, 2-(5-nitrofuran-2-yl)-1H-benzo[d]imidazole, 2-(5-Nitro-2-furanyl)-1H-benzimidazole, 2-(5-Nitro-2-furyl)benzimidazole
| Molecular Formula | C11H7N3O3 |
|---|---|
| Molecular Weight | 229.05 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 87.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.04874 |
| Heavy Atoms | 17 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 3945-78-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | GOUDVMWLWAFVMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Benzimidazole, 2-(5-nitro-2-furanyl)- (CAS 3945-78-6), with molecular formula C11H7N3O3 and molecular weight 229.05 g/mol. IUPAC: 2-(5-nitrofuran-2-yl)-1H-benzimidazole.
Chemical Property Profile of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-
Property Insights of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-. Following Lipinski's Rule of Five, 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- has 1 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 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-?
The CAS number of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- is 3945-78-6.
What is the molecular formula of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-?
The molecular formula of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- is C11H7N3O3.
What is the molecular weight of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-?
The molecular weight of 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- is 229.05 g/mol.
Where can I buy 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-?
You can request a quote for 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole, 2-(5-nitro-2-furanyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole, 2-(5-nitro-2-furanyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.