2-Methyl-5-nitro-1H-imidazole-1-propanoic acid
TL;DR: 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid (CAS 16935-04-9) is a chemical compound with molecular formula C7H9N3O4 and molecular weight 199.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methyl-5-nitroimidazol-1-yl)propanoic acid
Also Known As: 3-(2-methyl-5-nitro-1H-imidazol-1-yl)propanoic acid, 3-(2-methyl-5-nitroimidazol-1-yl)propanoic acid, 2-Methyl-5-nitro-1-imidazolepropionic acid, 3-(2-methyl-5-nitro-imidazol-1-yl)propanoic Acid, 2-methyl-5-nitro-1H-Imidazole-1-propanoic acid
| Molecular Formula | C7H9N3O4 |
|---|---|
| Molecular Weight | 199.06 g/mol |
| LogP | 0.57442 |
| Topological Polar Surface Area | 98.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.05931 |
| Heavy Atoms | 14 |
| Complexity | 371.01184 |
Chemical Identifiers
| CAS Number | 16935-04-9 |
|---|---|
| SMILES | CC1=NC=C(N1CCC(=O)O)[N+](=O)[O-] |
Product Overview
2-Methyl-5-nitro-1H-imidazole-1-propanoic acid (CAS 16935-04-9), with molecular formula C7H9N3O4 and molecular weight 199.06 g/mol. IUPAC: 3-(2-methyl-5-nitroimidazol-1-yl)propanoic acid.
Chemical Property Profile of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid
Property Insights of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid
The XLogP value of 0.57442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid. The TPSA of 98.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid. Following Lipinski's Rule of Five, 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid 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 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid?
The CAS number of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid is 16935-04-9.
What is the molecular formula of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid?
The molecular formula of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid is C7H9N3O4.
What is the molecular weight of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid?
The molecular weight of 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid is 199.06 g/mol.
Where can I buy 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid?
You can request a quote for 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-nitro-1H-imidazole-1-propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.