1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate
TL;DR: 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate (CAS 79478-50-5) is a chemical compound with molecular formula C17H12Cl3N3O4 and molecular weight 426.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(4-chlorophenyl)-3-(2,4-dichlorophenyl)oxiran-2-yl]imidazole;nitric acid
Also Known As: 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate, 1-(1,2-Epoxy-2-(4-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl)imidazole nitrate, 1H-Imidazole, 1-(3-(4-chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-, mononitrate, 1-[3-(4-chlorophenyl)-3-(2,4-dichlorophenyl)oxiran-2-yl]imidazole; nitric acid, Nitric acid--1-[3-(4-chlorophenyl)-3-(2,4-dichlorophenyl)oxiran-2-yl]-1H-imidazole (1/1)
| Molecular Formula | C17H12Cl3N3O4 |
|---|---|
| Molecular Weight | 426.99 g/mol |
| LogP | 4.9682 |
| Topological Polar Surface Area | 93.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.98935 |
| Heavy Atoms | 27 |
| Complexity | 946.5673 |
Chemical Identifiers
| CAS Number | 79478-50-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2(C(O2)N3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl)Cl.[N+](=O)(O)[O-] |
Product Overview
1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate (CAS 79478-50-5), with molecular formula C17H12Cl3N3O4 and molecular weight 426.99 g/mol. IUPAC: 1-[3-(4-chlorophenyl)-3-(2,4-dichlorophenyl)oxiran-2-yl]imidazole;nitric acid.
Chemical Property Profile of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate
Property Insights of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate
The XLogP value of 4.9682 indicates that 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate. Following Lipinski's Rule of Five, 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate has 1 hydrogen bond donor(s) and 4 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-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate?
The CAS number of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate is 79478-50-5.
What is the molecular formula of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate?
The molecular formula of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate is C17H12Cl3N3O4.
What is the molecular weight of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate?
The molecular weight of 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate is 426.99 g/mol.
Where can I buy 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate?
You can request a quote for 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)oxiranyl)-1H-imidazole mononitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.