1-isopropyl-2-methyl-4-nitro-1H-imidazole
TL;DR: 1-isopropyl-2-methyl-4-nitro-1H-imidazole (CAS 35179-52-3) is a chemical compound with molecular formula C7H11N3O2 and molecular weight 169.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-nitro-1-propan-2-ylimidazole
Also Known As: 1-isopropyl-2-methyl-4-nitro-1H-imidazole, 2-methyl-4-nitro-1-propan-2-ylimidazole, Maybridge1_002175, 1-Isopropyl-2-methyl-4-nitroimidazol, 1-Isopropyl-2-methyl-4-nitroimidazole
| Molecular Formula | C7H11N3O2 |
|---|---|
| Molecular Weight | 169.09 g/mol |
| LogP | 1.68062 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.08513 |
| Heavy Atoms | 12 |
| Complexity | 303.6002 |
Chemical Identifiers
| CAS Number | 35179-52-3 |
|---|---|
| SMILES | CC1=NC(=CN1C(C)C)[N+](=O)[O-] |
Product Overview
1-isopropyl-2-methyl-4-nitro-1H-imidazole (CAS 35179-52-3), with molecular formula C7H11N3O2 and molecular weight 169.09 g/mol. IUPAC: 2-methyl-4-nitro-1-propan-2-ylimidazole.
Chemical Property Profile of 1-isopropyl-2-methyl-4-nitro-1H-imidazole
Property Insights of 1-isopropyl-2-methyl-4-nitro-1H-imidazole
The XLogP value of 1.68062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-isopropyl-2-methyl-4-nitro-1H-imidazole. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-isopropyl-2-methyl-4-nitro-1H-imidazole. Following Lipinski's Rule of Five, 1-isopropyl-2-methyl-4-nitro-1H-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 1-isopropyl-2-methyl-4-nitro-1H-imidazole?
The CAS number of 1-isopropyl-2-methyl-4-nitro-1H-imidazole is 35179-52-3.
What is the molecular formula of 1-isopropyl-2-methyl-4-nitro-1H-imidazole?
The molecular formula of 1-isopropyl-2-methyl-4-nitro-1H-imidazole is C7H11N3O2.
What is the molecular weight of 1-isopropyl-2-methyl-4-nitro-1H-imidazole?
The molecular weight of 1-isopropyl-2-methyl-4-nitro-1H-imidazole is 169.09 g/mol.
Where can I buy 1-isopropyl-2-methyl-4-nitro-1H-imidazole?
You can request a quote for 1-isopropyl-2-methyl-4-nitro-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-isopropyl-2-methyl-4-nitro-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-isopropyl-2-methyl-4-nitro-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.