1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole
TL;DR: 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole (CAS 338955-07-0) is a chemical compound with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methoxyphenyl)methyl]-2,5,6-trimethyl-4-nitrobenzimidazole
Also Known As: 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole, 1-[(4-methoxyphenyl)methyl]-2,5,6-trimethyl-4-nitro-1H-1,3-benzodiazole, 1-[(4-methoxyphenyl)methyl]-2,5,6-trimethyl-4-nitrobenzimidazole, 1-[(4-methoxyphenyl)methyl]-2,5,6-trimethyl-4-nitro-benzimidazole, 1-[(4-methoxyphenyl)methyl]-2,5,6-trimethyl-4-nitro-benzoimidazole
| Molecular Formula | C18H19N3O3 |
|---|---|
| Molecular Weight | 325.14 g/mol |
| LogP | 3.92666 |
| Topological Polar Surface Area | 70.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.14264 |
| Heavy Atoms | 24 |
| Complexity | 927.07227 |
Chemical Identifiers
| CAS Number | 338955-07-0 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1C)[N+](=O)[O-])N=C(N2CC3=CC=C(C=C3)OC)C |
Product Overview
1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole (CAS 338955-07-0), with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol. IUPAC: 1-[(4-methoxyphenyl)methyl]-2,5,6-trimethyl-4-nitrobenzimidazole.
Chemical Property Profile of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole
Property Insights of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole
The XLogP value of 3.92666 indicates that 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole. Following Lipinski's Rule of Five, 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole has 0 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 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole?
The CAS number of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole is 338955-07-0.
What is the molecular formula of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole?
The molecular formula of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole is C18H19N3O3.
What is the molecular weight of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole?
The molecular weight of 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole is 325.14 g/mol.
Where can I buy 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole?
You can request a quote for 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methoxybenzyl)-2,5,6-trimethyl-4-nitro-1H-1,3-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.