2-(2'-Nitrophenyl)benzimidazole
TL;DR: 2-(2'-Nitrophenyl)benzimidazole (CAS 2208-58-4) is a chemical compound with molecular formula C13H9N3O2 and molecular weight 239.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitrophenyl)-1H-benzimidazole
Also Known As: 2-(2-Nitrophenyl)-1H-benzimidazole, 2-nitrophenylbenzimidazole, 2-(o-Nitrophenyl)benzimidazole, 1H-Benzimidazole, 2-(2-nitrophenyl)-, 2-(2-nitrophenyl)benzimidazole
| Molecular Formula | C13H9N3O2 |
|---|---|
| Molecular Weight | 239.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.06947 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 2208-58-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)[N+](=O)[O-] |
| InChIKey | QJPPXVVTXDVWAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2'-Nitrophenyl)benzimidazole (CAS 2208-58-4), with molecular formula C13H9N3O2 and molecular weight 239.07 g/mol. IUPAC: 2-(2-nitrophenyl)-1H-benzimidazole.
Chemical Property Profile of 2-(2'-Nitrophenyl)benzimidazole
Property Insights of 2-(2'-Nitrophenyl)benzimidazole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2'-Nitrophenyl)benzimidazole. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2'-Nitrophenyl)benzimidazole. Following Lipinski's Rule of Five, 2-(2'-Nitrophenyl)benzimidazole has 1 hydrogen bond donor(s) and 3 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 2-(2'-Nitrophenyl)benzimidazole?
The CAS number of 2-(2'-Nitrophenyl)benzimidazole is 2208-58-4.
What is the molecular formula of 2-(2'-Nitrophenyl)benzimidazole?
The molecular formula of 2-(2'-Nitrophenyl)benzimidazole is C13H9N3O2.
What is the molecular weight of 2-(2'-Nitrophenyl)benzimidazole?
The molecular weight of 2-(2'-Nitrophenyl)benzimidazole is 239.07 g/mol.
Where can I buy 2-(2'-Nitrophenyl)benzimidazole?
You can request a quote for 2-(2'-Nitrophenyl)benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2'-Nitrophenyl)benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2'-Nitrophenyl)benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.