1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate
TL;DR: 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate (CAS 79478-40-3) is a chemical compound with molecular formula C18H15Cl2N3O4 and molecular weight 407.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(2,4-dichlorophenyl)methyl]-3-phenyloxiran-2-yl]imidazole;nitric acid
Also Known As: 1-(3-((2,4-Dichlorophenyl)methyl)-3-phenyloxiranyl)-1H-imidazole mononitrate, 1-(1,2-Epoxy-3-(2,4-dichlorophenyl)-2-phenylpropyl)imidazole nitrate, 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate, 1-[3-[(2,4-dichlorophenyl)methyl]-3-phenyloxiran-2-yl]imidazole; nitric acid, Nitric acid--1-{3-[(2,4-dichlorophenyl)methyl]-3-phenyloxiran-2-yl}-1H-imidazole (1/1)
| Molecular Formula | C18H15Cl2N3O4 |
|---|---|
| Molecular Weight | 407.04 g/mol |
| LogP | 4.5092 |
| Topological Polar Surface Area | 93.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.04398 |
| Heavy Atoms | 27 |
| Complexity | 917.62085 |
Chemical Identifiers
| CAS Number | 79478-40-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2(C(O2)N3C=CN=C3)CC4=C(C=C(C=C4)Cl)Cl.[N+](=O)(O)[O-] |
Product Overview
1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate (CAS 79478-40-3), with molecular formula C18H15Cl2N3O4 and molecular weight 407.04 g/mol. IUPAC: 1-[3-[(2,4-dichlorophenyl)methyl]-3-phenyloxiran-2-yl]imidazole;nitric acid.
Chemical Property Profile of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate
Property Insights of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate
The XLogP value of 4.5092 indicates that 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, 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 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate. Following Lipinski's Rule of Five, 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, 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 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate?
The CAS number of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate is 79478-40-3.
What is the molecular formula of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate?
The molecular formula of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate is C18H15Cl2N3O4.
What is the molecular weight of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate?
The molecular weight of 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate is 407.04 g/mol.
Where can I buy 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate?
You can request a quote for 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.