1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate
TL;DR: 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate (CAS 61258-37-5) is a chemical compound with molecular formula C16H19Cl2N3O4 and molecular weight 387.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2,4-dichlorophenyl)-2-prop-2-enoxybutyl]imidazole;nitric acid
Also Known As: 1-(4-(2,4-Dichlorophenyl)-2-(2-propenyloxy)butyl)-1H-imidazole nitrate, 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate, 1-[4-(2,4-dichlorophenyl)-2-prop-2-enoxybutyl]imidazole; nitric acid, Nitric acid--1-{4-(2,4-dichlorophenyl)-2-[(prop-2-en-1-yl)oxy]butyl}-1H-imidazole (1/1), RefChem:238009
| Molecular Formula | C16H19Cl2N3O4 |
|---|---|
| Molecular Weight | 387.08 g/mol |
| LogP | 4.0462 |
| Topological Polar Surface Area | 90.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 387.07526 |
| Heavy Atoms | 25 |
| Complexity | 661.40436 |
Chemical Identifiers
| CAS Number | 61258-37-5 |
|---|---|
| SMILES | C=CCOC(CCC1=C(C=C(C=C1)Cl)Cl)CN2C=CN=C2.[N+](=O)(O)[O-] |
Product Overview
1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate (CAS 61258-37-5), with molecular formula C16H19Cl2N3O4 and molecular weight 387.08 g/mol. IUPAC: 1-[4-(2,4-dichlorophenyl)-2-prop-2-enoxybutyl]imidazole;nitric acid.
Chemical Property Profile of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate
Property Insights of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate
The XLogP value of 4.0462 indicates that 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, 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-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate. Following Lipinski's Rule of Five, 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, 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-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate?
The CAS number of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate is 61258-37-5.
What is the molecular formula of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate?
The molecular formula of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate is C16H19Cl2N3O4.
What is the molecular weight of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate?
The molecular weight of 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate is 387.08 g/mol.
Where can I buy 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate?
You can request a quote for 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, 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-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 1-(4-(2,4-dichlorophenyl)-2-(2-propenyloxy)butyl)-, mononitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.