![1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] structure](/static/products/7182/71821-52-8.webp)
1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]
TL;DR: 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] (CAS 71821-52-8) is a chemical compound with molecular formula C21H22Cl3N3O4S and molecular weight 517.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[4-(4-chlorophenyl)sulfanylbutoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
Also Known As: 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German], 1H-Imidazole, 1-(2-(4-((4-chlorophenyl)thio)butoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate, 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat, 1-[2-[4-(4-chlorophenyl)sulfanylbutoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole; nitric acid, Nitric acid--1-[2-{4-[(4-chlorophenyl)sulfanyl]butoxy}-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole (1/1)
| Molecular Formula | C21H22Cl3N3O4S |
|---|---|
| Molecular Weight | 517.04 g/mol |
| LogP | 6.826 |
| Topological Polar Surface Area | 90.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 517.0397 |
| Heavy Atoms | 32 |
| Complexity | 955.43353 |
Chemical Identifiers
| CAS Number | 71821-52-8 |
|---|---|
| SMILES | C1=CC(=CC=C1SCCCCOC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-] |
Product Overview
1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] (CAS 71821-52-8), with molecular formula C21H22Cl3N3O4S and molecular weight 517.04 g/mol. IUPAC: 1-[2-[4-(4-chlorophenyl)sulfanylbutoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid.
Chemical Property Profile of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]
Property Insights of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]
The XLogP value of 6.826 indicates that 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] 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-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]. Following Lipinski's Rule of Five, 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] 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-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]?
The CAS number of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] is 71821-52-8.
What is the molecular formula of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]?
The molecular formula of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] is C21H22Cl3N3O4S.
What is the molecular weight of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]?
The molecular weight of 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] is 517.04 g/mol.
Where can I buy 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]?
You can request a quote for 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German]?
Yes, KEHONG BIO provides custom synthesis services for 1-(beta-(4-(p-Chlorphenylthio)-butoxy)-2,4-dichlorphenaethyl)-imidazol-nitrat [German] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.