1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol
TL;DR: 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol (CAS 852388-94-4) is a chemical compound with molecular formula C12H14N2S and molecular weight 218.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-4-(4-methylphenyl)-1H-imidazole-2-thione
Also Known As: 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol, 3-ethyl-4-(4-methylphenyl)-1H-imidazole-2-thione, 1-ethyl-5-(p-tolyl)-1H-imidazole-2-thiol, 1-ethyl-5-(4-methylphenyl)imidazole-2-thiol, 3-ethyl-4-(p-tolyl)-1H-imidazole-2-thione
| Molecular Formula | C12H14N2S |
|---|---|
| Molecular Weight | 218.09 g/mol |
| LogP | 3.54101 |
| Topological Polar Surface Area | 20.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.08777 |
| Heavy Atoms | 15 |
| Complexity | 505.16354 |
Chemical Identifiers
| CAS Number | 852388-94-4 |
|---|---|
| SMILES | CCN1C(=CNC1=S)C2=CC=C(C=C2)C |
Product Overview
1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol (CAS 852388-94-4), with molecular formula C12H14N2S and molecular weight 218.09 g/mol. IUPAC: 3-ethyl-4-(4-methylphenyl)-1H-imidazole-2-thione.
Chemical Property Profile of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol
Property Insights of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol
The XLogP value of 3.54101 indicates that 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.72 Ų, 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol 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 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol?
The CAS number of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol is 852388-94-4.
What is the molecular formula of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol?
The molecular formula of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol is C12H14N2S.
What is the molecular weight of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol?
The molecular weight of 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol is 218.09 g/mol.
Where can I buy 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol?
You can request a quote for 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 1-ethyl-5-(4-methylphenyl)-1H-imidazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.