1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate
TL;DR: 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate (CAS 71821-44-8) is a chemical compound with molecular formula C20H20Cl3N3O4S and molecular weight 503.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[3-(4-chlorophenyl)sulfanylpropoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
Also Known As: 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate, 1-(beta-(3-(p-Chlorphenylthio)-propoxy-2,4-dichlorphenaethyl))-imidazol-nitrat [German], 1H-Imidazole, 1-(2-(3-((4-chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate, 1-(beta-(3-(p-Chlorphenylthio)-propoxy-2,4-dichlorphenaethyl))-imidazol-nitrat, 1-[2-[3-(4-chlorophenyl)sulfanylpropoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole; nitric acid
| Molecular Formula | C20H20Cl3N3O4S |
|---|---|
| Molecular Weight | 503.02 g/mol |
| LogP | 6.4359 |
| Topological Polar Surface Area | 90.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 503.02402 |
| Heavy Atoms | 31 |
| Complexity | 939.3529 |
Chemical Identifiers
| CAS Number | 71821-44-8 |
|---|---|
| SMILES | C1=CC(=CC=C1SCCCOC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-] |
Product Overview
1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate (CAS 71821-44-8), with molecular formula C20H20Cl3N3O4S and molecular weight 503.02 g/mol. IUPAC: 1-[2-[3-(4-chlorophenyl)sulfanylpropoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid.
Chemical Property Profile of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate
Property Insights of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate
The XLogP value of 6.4359 indicates that 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate. Following Lipinski's Rule of Five, 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate?
The CAS number of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate is 71821-44-8.
What is the molecular formula of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate?
The molecular formula of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate is C20H20Cl3N3O4S.
What is the molecular weight of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate?
The molecular weight of 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate is 503.02 g/mol.
Where can I buy 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate?
You can request a quote for 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(3-((4-Chlorophenyl)thio)propoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.