3-(2,6-dichlorophenyl)-1H-imidazole-2-thione
TL;DR: 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione (CAS 17452-22-1) is a chemical compound with molecular formula C9H6Cl2N2S and molecular weight 243.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,6-dichlorophenyl)-1H-imidazole-2-thione
Also Known As: 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione, 1-(2,6-Dichlorophenyl)-1,3-dihydro-2H-imidazole-2-thione
| Molecular Formula | C9H6Cl2N2S |
|---|---|
| Molecular Weight | 243.96 g/mol |
| LogP | 3.84169 |
| Topological Polar Surface Area | 20.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.96288 |
| Heavy Atoms | 14 |
| Complexity | 495.27567 |
Chemical Identifiers
| CAS Number | 17452-22-1 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)N2C=CNC2=S)Cl |
Product Overview
3-(2,6-dichlorophenyl)-1H-imidazole-2-thione (CAS 17452-22-1), with molecular formula C9H6Cl2N2S and molecular weight 243.96 g/mol. IUPAC: 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione.
Chemical Property Profile of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione
Property Insights of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione
The XLogP value of 3.84169 indicates that 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.72 Ų, 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione 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 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione?
The CAS number of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione is 17452-22-1.
What is the molecular formula of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione?
The molecular formula of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione is C9H6Cl2N2S.
What is the molecular weight of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione?
The molecular weight of 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione is 243.96 g/mol.
Where can I buy 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione?
You can request a quote for 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,6-dichlorophenyl)-1H-imidazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.