![2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole structure](/static/products/548/54821-01-1.png)
2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole
TL;DR: 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole (CAS 54821-01-1) is a chemical compound with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-[(4-nitrophenyl)methyl]benzimidazole
Also Known As: 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole, 2-methyl-1-[(4-nitrophenyl)methyl]benzimidazole
| Molecular Formula | C15H13N3O2 |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 3.30122 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.10077 |
| Heavy Atoms | 20 |
| Complexity | 775.4179 |
Chemical Identifiers
| CAS Number | 54821-01-1 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole (CAS 54821-01-1), with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol. IUPAC: 2-methyl-1-[(4-nitrophenyl)methyl]benzimidazole.
Chemical Property Profile of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole
Property Insights of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole
The XLogP value of 3.30122 indicates that 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole. Following Lipinski's Rule of Five, 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole has 0 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-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole?
The CAS number of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole is 54821-01-1.
What is the molecular formula of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole?
The molecular formula of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole is C15H13N3O2.
What is the molecular weight of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole?
The molecular weight of 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole is 267.10 g/mol.
Where can I buy 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole?
You can request a quote for 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-[(4-nitrophenyl)methyl]-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.