1-Methyl-5-nitro-2-styrylimidazole
TL;DR: 1-Methyl-5-nitro-2-styrylimidazole (CAS 4750-56-5) is a chemical compound with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-nitro-2-(2-phenylethenyl)imidazole
Also Known As: 1-methyl-5-nitro-2-styrylimidazole, 1-methyl-5-nitro-2-(2-phenylethenyl)imidazole, 1H-Imidazole,1-methyl-5-nitro-2-(2-phenylethenyl)-, 1-Methyl-5-nitro-2-(2-phenylethen-1-yl)-1H-imidazole
| Molecular Formula | C12H11N3O2 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.08513 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 4750-56-5 |
|---|---|
| SMILES | CN1C(=CN=C1C=CC2=CC=CC=C2)[N+](=O)[O-] |
| InChIKey | HGBWQGJWYQJSEA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-5-nitro-2-styrylimidazole (CAS 4750-56-5), with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol. IUPAC: 1-methyl-5-nitro-2-(2-phenylethenyl)imidazole.
Chemical Property Profile of 1-Methyl-5-nitro-2-styrylimidazole
Property Insights of 1-Methyl-5-nitro-2-styrylimidazole
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-5-nitro-2-styrylimidazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-5-nitro-2-styrylimidazole. Following Lipinski's Rule of Five, 1-Methyl-5-nitro-2-styrylimidazole 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 1-Methyl-5-nitro-2-styrylimidazole?
The CAS number of 1-Methyl-5-nitro-2-styrylimidazole is 4750-56-5.
What is the molecular formula of 1-Methyl-5-nitro-2-styrylimidazole?
The molecular formula of 1-Methyl-5-nitro-2-styrylimidazole is C12H11N3O2.
What is the molecular weight of 1-Methyl-5-nitro-2-styrylimidazole?
The molecular weight of 1-Methyl-5-nitro-2-styrylimidazole is 229.09 g/mol.
Where can I buy 1-Methyl-5-nitro-2-styrylimidazole?
You can request a quote for 1-Methyl-5-nitro-2-styrylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-5-nitro-2-styrylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-5-nitro-2-styrylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.