4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid
TL;DR: 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid (CAS 128293-64-1) is a chemical compound with molecular formula C10H15N3O4 and molecular weight 241.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]imidazole-2-carboxylic acid
Also Known As: 4-((tert-Butoxycarbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid, TITANIUMDIOXIDE, 4-(boc-amino)-1-methyl-1h-imidazole-2-carboxylic acid, 4-tert-butoxycarbonylamino-1-methyl-1h-imidazole-2-carboxylic acid, boc-nh(4)-meimd-(2)-oh
| Molecular Formula | C10H15N3O4 |
|---|---|
| Molecular Weight | 241.11 g/mol |
| LogP | 1.4653 |
| Topological Polar Surface Area | 93.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.10626 |
| Heavy Atoms | 17 |
| Complexity | 444.89377 |
Chemical Identifiers
| CAS Number | 128293-64-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=CN(C(=N1)C(=O)O)C |
Product Overview
4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid (CAS 128293-64-1), with molecular formula C10H15N3O4 and molecular weight 241.11 g/mol. IUPAC: 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]imidazole-2-carboxylic acid.
Chemical Property Profile of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid
Property Insights of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid
The XLogP value of 1.4653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid. The TPSA of 93.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid. Following Lipinski's Rule of Five, 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid has 2 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 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid?
The CAS number of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid is 128293-64-1.
What is the molecular formula of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid?
The molecular formula of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid is C10H15N3O4.
What is the molecular weight of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid?
The molecular weight of 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid is 241.11 g/mol.
Where can I buy 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid?
You can request a quote for 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(((1,1-Dimethylethoxy)carbonyl)amino)-1-methyl-1H-imidazole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.