4-(2',4',6'-Trimethylbenzyl)imidazole
TL;DR: 4-(2',4',6'-Trimethylbenzyl)imidazole (CAS 78892-53-2) is a chemical compound with molecular formula C13H16N2 and molecular weight 200.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,4,6-trimethylphenyl)methyl]-1H-imidazole
Also Known As: 4- -1H-imidazole, 4-(2',4',6'-Trimethylbenzyl)imidazole, 1H-Imidazole, 5-[(2,4,6-trimethylphenyl)methyl]-, 4-[(2,4,6-trimethylphenyl)methyl]-3H-imidazole, 5-[(2,4,6-trimethylphenyl)methyl]-1H-imidazole
| Molecular Formula | C13H16N2 |
|---|---|
| Molecular Weight | 200.13 g/mol |
| LogP | 2.92576 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.13135 |
| Heavy Atoms | 15 |
| Complexity | 432.38824 |
Chemical Identifiers
| CAS Number | 78892-53-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)CC2=CN=CN2)C |
Product Overview
4-(2',4',6'-Trimethylbenzyl)imidazole (CAS 78892-53-2), with molecular formula C13H16N2 and molecular weight 200.13 g/mol. IUPAC: 5-[(2,4,6-trimethylphenyl)methyl]-1H-imidazole.
Chemical Property Profile of 4-(2',4',6'-Trimethylbenzyl)imidazole
Property Insights of 4-(2',4',6'-Trimethylbenzyl)imidazole
The XLogP value of 2.92576 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2',4',6'-Trimethylbenzyl)imidazole. With a topological polar surface area (TPSA) of 28.68 Ų, 4-(2',4',6'-Trimethylbenzyl)imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2',4',6'-Trimethylbenzyl)imidazole has 1 hydrogen bond donor(s) and 1 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-(2',4',6'-Trimethylbenzyl)imidazole?
The CAS number of 4-(2',4',6'-Trimethylbenzyl)imidazole is 78892-53-2.
What is the molecular formula of 4-(2',4',6'-Trimethylbenzyl)imidazole?
The molecular formula of 4-(2',4',6'-Trimethylbenzyl)imidazole is C13H16N2.
What is the molecular weight of 4-(2',4',6'-Trimethylbenzyl)imidazole?
The molecular weight of 4-(2',4',6'-Trimethylbenzyl)imidazole is 200.13 g/mol.
Where can I buy 4-(2',4',6'-Trimethylbenzyl)imidazole?
You can request a quote for 4-(2',4',6'-Trimethylbenzyl)imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2',4',6'-Trimethylbenzyl)imidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(2',4',6'-Trimethylbenzyl)imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.