![1-[4-(propan-2-yl)benzyl]-1H-imidazole structure](/static/products/111/111371-14-3.png)
1-[4-(propan-2-yl)benzyl]-1H-imidazole
TL;DR: 1-[4-(propan-2-yl)benzyl]-1H-imidazole (CAS 111371-14-3) 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.
1-[(4-propan-2-ylphenyl)methyl]imidazole
Also Known As: 1-(4-isopropylbenzyl)-1H-imidazole, {[4-(methylethyl)phenyl]methyl}imidazole, 1-[(4-propan-2-ylphenyl)methyl]imidazole, 1-[4-(propan-2-yl)benzyl]-1H-imidazole, 1H-Imidazole, 1-[[4-(1-methylethyl)phenyl]methyl]-
| Molecular Formula | C13H16N2 |
|---|---|
| Molecular Weight | 200.13 g/mol |
| LogP | 3.0548 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.13135 |
| Heavy Atoms | 15 |
| Complexity | 398.6108 |
Chemical Identifiers
| CAS Number | 111371-14-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CN2C=CN=C2 |
Product Overview
1-[4-(propan-2-yl)benzyl]-1H-imidazole (CAS 111371-14-3), with molecular formula C13H16N2 and molecular weight 200.13 g/mol. IUPAC: 1-[(4-propan-2-ylphenyl)methyl]imidazole.
Chemical Property Profile of 1-[4-(propan-2-yl)benzyl]-1H-imidazole
Property Insights of 1-[4-(propan-2-yl)benzyl]-1H-imidazole
The XLogP value of 3.0548 indicates that 1-[4-(propan-2-yl)benzyl]-1H-imidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1-[4-(propan-2-yl)benzyl]-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(propan-2-yl)benzyl]-1H-imidazole has 0 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 1-[4-(propan-2-yl)benzyl]-1H-imidazole?
The CAS number of 1-[4-(propan-2-yl)benzyl]-1H-imidazole is 111371-14-3.
What is the molecular formula of 1-[4-(propan-2-yl)benzyl]-1H-imidazole?
The molecular formula of 1-[4-(propan-2-yl)benzyl]-1H-imidazole is C13H16N2.
What is the molecular weight of 1-[4-(propan-2-yl)benzyl]-1H-imidazole?
The molecular weight of 1-[4-(propan-2-yl)benzyl]-1H-imidazole is 200.13 g/mol.
Where can I buy 1-[4-(propan-2-yl)benzyl]-1H-imidazole?
You can request a quote for 1-[4-(propan-2-yl)benzyl]-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(propan-2-yl)benzyl]-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(propan-2-yl)benzyl]-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.