4,5-Dichloro-1-(4-nitrophenyl)imidazole
TL;DR: 4,5-Dichloro-1-(4-nitrophenyl)imidazole (CAS 649579-09-9) is a chemical compound with molecular formula C9H5Cl2N3O2 and molecular weight 256.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dichloro-1-(4-nitrophenyl)imidazole
Also Known As: 4,5-dichloro-1-(4-nitrophenyl)imidazole, 4,5-dichloro-1-(4-nitrophenyl)-1H-imidazole, 1H-Imidazole,4,5-dichloro-1-(4-nitrophenyl)-, RefChem:285297
| Molecular Formula | C9H5Cl2N3O2 |
|---|---|
| Molecular Weight | 256.98 g/mol |
| LogP | 3.0873 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.9759 |
| Heavy Atoms | 16 |
| Complexity | 536.1872 |
Chemical Identifiers
| CAS Number | 649579-09-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C=NC(=C2Cl)Cl)[N+](=O)[O-] |
Product Overview
4,5-Dichloro-1-(4-nitrophenyl)imidazole (CAS 649579-09-9), with molecular formula C9H5Cl2N3O2 and molecular weight 256.98 g/mol. IUPAC: 4,5-dichloro-1-(4-nitrophenyl)imidazole.
Chemical Property Profile of 4,5-Dichloro-1-(4-nitrophenyl)imidazole
Property Insights of 4,5-Dichloro-1-(4-nitrophenyl)imidazole
The XLogP value of 3.0873 indicates that 4,5-Dichloro-1-(4-nitrophenyl)imidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dichloro-1-(4-nitrophenyl)imidazole. Following Lipinski's Rule of Five, 4,5-Dichloro-1-(4-nitrophenyl)imidazole has 0 hydrogen bond donor(s) and 3 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 4,5-Dichloro-1-(4-nitrophenyl)imidazole?
The CAS number of 4,5-Dichloro-1-(4-nitrophenyl)imidazole is 649579-09-9.
What is the molecular formula of 4,5-Dichloro-1-(4-nitrophenyl)imidazole?
The molecular formula of 4,5-Dichloro-1-(4-nitrophenyl)imidazole is C9H5Cl2N3O2.
What is the molecular weight of 4,5-Dichloro-1-(4-nitrophenyl)imidazole?
The molecular weight of 4,5-Dichloro-1-(4-nitrophenyl)imidazole is 256.98 g/mol.
Where can I buy 4,5-Dichloro-1-(4-nitrophenyl)imidazole?
You can request a quote for 4,5-Dichloro-1-(4-nitrophenyl)imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dichloro-1-(4-nitrophenyl)imidazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dichloro-1-(4-nitrophenyl)imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.