2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol
TL;DR: 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol (CAS 326900-72-5) is a chemical compound with molecular formula C22H18N4O3 and molecular weight 386.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-benzyl-2-methylbenzimidazol-5-yl)iminomethyl]-4-nitrophenol
Also Known As: BAS 00619456, 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol, 2-[(1-Benzyl-2-methyl-1H-benzoimidazol-5-ylimino)-methyl]-4-nitro-phenol, 2-[(Z)-(1-benzyl-2-methyl-benzimidazol-5-yl)iminomethyl]-4-nitro-phenol, 2-{(1Z)-2-[2-methyl-1-benzylbenzimidazol-5-yl]-2-azavinyl}-4-nitrophenol
| Molecular Formula | C22H18N4O3 |
|---|---|
| Molecular Weight | 386.14 g/mol |
| LogP | 4.75742 |
| Topological Polar Surface Area | 93.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.13788 |
| Heavy Atoms | 29 |
| Complexity | 1229.78 |
Chemical Identifiers
| CAS Number | 326900-72-5 |
|---|---|
| SMILES | CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)N=CC4=C(C=CC(=C4)[N+](=O)[O-])O |
Product Overview
2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol (CAS 326900-72-5), with molecular formula C22H18N4O3 and molecular weight 386.14 g/mol. IUPAC: 2-[(1-benzyl-2-methylbenzimidazol-5-yl)iminomethyl]-4-nitrophenol.
Chemical Property Profile of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol
Property Insights of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol
The XLogP value of 4.75742 indicates that 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol. Following Lipinski's Rule of Five, 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol has 1 hydrogen bond donor(s) and 5 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-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol?
The CAS number of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol is 326900-72-5.
What is the molecular formula of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol?
The molecular formula of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol is C22H18N4O3.
What is the molecular weight of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol?
The molecular weight of 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol is 386.14 g/mol.
Where can I buy 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol?
You can request a quote for 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-{(E)-[(1-benzyl-2-methyl-1H-benzimidazol-5-yl)imino]methyl}-4-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.