1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate
TL;DR: 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate (CAS 74287-44-8) is a chemical compound with molecular formula C17H21Cl2N3O4 and molecular weight 401.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-2-(2,4-dichlorophenyl)-2-hexoxyethenyl]imidazole;nitric acid
Also Known As: 1-(2-(2,4-Dichlorophenyl)-2-(hexyloxy)ethenyl)-1H-imidazole nitrate, 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate, 1-[(E)-2-(2,4-dichlorophenyl)-2-hexoxyethenyl]imidazole; nitric acid, RefChem:1057914
| Molecular Formula | C17H21Cl2N3O4 |
|---|---|
| Molecular Weight | 401.09 g/mol |
| LogP | 5.3947 |
| Topological Polar Surface Area | 90.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 401.0909 |
| Heavy Atoms | 26 |
| Complexity | 702.03845 |
Chemical Identifiers
| CAS Number | 74287-44-8 |
|---|---|
| SMILES | CCCCCCO/C(=C/N1C=CN=C1)/C2=C(C=C(C=C2)Cl)Cl.[N+](=O)(O)[O-] |
Product Overview
1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate (CAS 74287-44-8), with molecular formula C17H21Cl2N3O4 and molecular weight 401.09 g/mol. IUPAC: 1-[(E)-2-(2,4-dichlorophenyl)-2-hexoxyethenyl]imidazole;nitric acid.
Chemical Property Profile of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate
Property Insights of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate
The XLogP value of 5.3947 indicates that 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate 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 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate. Following Lipinski's Rule of Five, 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate?
The CAS number of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate is 74287-44-8.
What is the molecular formula of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate?
The molecular formula of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate is C17H21Cl2N3O4.
What is the molecular weight of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate?
The molecular weight of 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate is 401.09 g/mol.
Where can I buy 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate?
You can request a quote for 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, 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-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(hexyloxy)ethenyl)-, mononitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.