5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol
TL;DR: 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol (CAS 17452-31-2) is a chemical compound with molecular formula C10H9ClN2S and molecular weight 224.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-3-methyl-1H-imidazole-2-thione
Also Known As: 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol, Maybridge1_000141, MixCom1_000273, 4-(4-chlorophenyl)-3-methyl-1H-imidazole-2-thione, 5-(4-chlorophenyl)-1-methylimidazole-2-thiol
| Molecular Formula | C10H9ClN2S |
|---|---|
| Molecular Weight | 224.02 g/mol |
| LogP | 3.40309 |
| Topological Polar Surface Area | 20.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.0175 |
| Heavy Atoms | 14 |
| Complexity | 495.5857 |
Chemical Identifiers
| CAS Number | 17452-31-2 |
|---|---|
| SMILES | CN1C(=CNC1=S)C2=CC=C(C=C2)Cl |
Product Overview
5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol (CAS 17452-31-2), with molecular formula C10H9ClN2S and molecular weight 224.02 g/mol. IUPAC: 4-(4-chlorophenyl)-3-methyl-1H-imidazole-2-thione.
Chemical Property Profile of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol
Property Insights of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol
The XLogP value of 3.40309 indicates that 5-(4-chlorophenyl)-1-methyl-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, 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-chlorophenyl)-1-methyl-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 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol?
The CAS number of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol is 17452-31-2.
What is the molecular formula of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol?
The molecular formula of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol is C10H9ClN2S.
What is the molecular weight of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol?
The molecular weight of 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol is 224.02 g/mol.
Where can I buy 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol?
You can request a quote for 5-(4-chlorophenyl)-1-methyl-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 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-chlorophenyl)-1-methyl-1H-imidazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.