1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide
TL;DR: 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide (CAS 62533-85-1) is a chemical compound with molecular formula C7H10N4O3 and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2-methyl-5-nitroimidazole-4-carboxamide
Also Known As: 1-ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide, 3-ethyl-2-methyl-5-nitroimidazole-4-carboxamide, 1H-Imidazole-5-carboxamide,1-ethyl-2-methyl-4-nitro-, 3-Aethyl-2-methyl-5-nitro-3H-imidazol-4-carbonsaeure-amid
| Molecular Formula | C7H10N4O3 |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.07529 |
| Heavy Atoms | 14 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 62533-85-1 |
|---|---|
| SMILES | CCN1C(=NC(=C1C(=O)N)[N+](=O)[O-])C |
| InChIKey | CWHPJNSEKBIFIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide (CAS 62533-85-1), with molecular formula C7H10N4O3 and molecular weight 198.08 g/mol. IUPAC: 3-ethyl-2-methyl-5-nitroimidazole-4-carboxamide.
Chemical Property Profile of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide
Property Insights of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide. Following Lipinski's Rule of Five, 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide 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 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide?
The CAS number of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide is 62533-85-1.
What is the molecular formula of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide?
The molecular formula of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide is C7H10N4O3.
What is the molecular weight of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide?
The molecular weight of 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide is 198.08 g/mol.
Where can I buy 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide?
You can request a quote for 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-2-methyl-4-nitro-1h-imidazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.