4-nitro-2-phenyl-1H-benzimidazole
TL;DR: 4-nitro-2-phenyl-1H-benzimidazole (CAS 67152-21-0) 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.
4-nitro-2-phenyl-1H-benzimidazole
Also Known As: 4-nitro-2-phenyl-1H-benzimidazole, 2-Phenyl-4-nitro-1H-benzoimidazole, 1H-Benzimidazole, 7-nitro-2-phenyl-, 7-Nitro-2-phenyl-1H-benzimidazole, 7-Nitro-2-phenyl-1H-benzoimidazole
| Molecular Formula | C13H9N3O2 |
|---|---|
| Molecular Weight | 239.07 g/mol |
| LogP | 3.1381 |
| Topological Polar Surface Area | 71.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.06947 |
| Heavy Atoms | 18 |
| Complexity | 719.4394 |
Chemical Identifiers
| CAS Number | 67152-21-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3[N+](=O)[O-] |
Product Overview
4-nitro-2-phenyl-1H-benzimidazole (CAS 67152-21-0), with molecular formula C13H9N3O2 and molecular weight 239.07 g/mol. IUPAC: 4-nitro-2-phenyl-1H-benzimidazole.
Chemical Property Profile of 4-nitro-2-phenyl-1H-benzimidazole
Property Insights of 4-nitro-2-phenyl-1H-benzimidazole
The XLogP value of 3.1381 indicates that 4-nitro-2-phenyl-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-2-phenyl-1H-benzimidazole. Following Lipinski's Rule of Five, 4-nitro-2-phenyl-1H-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 4-nitro-2-phenyl-1H-benzimidazole?
The CAS number of 4-nitro-2-phenyl-1H-benzimidazole is 67152-21-0.
What is the molecular formula of 4-nitro-2-phenyl-1H-benzimidazole?
The molecular formula of 4-nitro-2-phenyl-1H-benzimidazole is C13H9N3O2.
What is the molecular weight of 4-nitro-2-phenyl-1H-benzimidazole?
The molecular weight of 4-nitro-2-phenyl-1H-benzimidazole is 239.07 g/mol.
Where can I buy 4-nitro-2-phenyl-1H-benzimidazole?
You can request a quote for 4-nitro-2-phenyl-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-2-phenyl-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-2-phenyl-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.