5-fluoro-1H-imidazole-4-carboxamide
TL;DR: 5-fluoro-1H-imidazole-4-carboxamide (CAS 33300-35-5) is a chemical compound with molecular formula C4H4FN3O and molecular weight 129.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-1H-imidazole-4-carboxamide
Also Known As: 5-fluoro-1H-imidazole-4-carboxamide, 4-fluoroimidazole-5-carboxamide, 1H-Imidazole-4-carboxamide, 5-fluoro-, 5-Fluoroimidazole-4-carboxylic amide, Imidazole, 4-fluoro-5-aminocarbonyl-
| Molecular Formula | C4H4FN3O |
|---|---|
| Molecular Weight | 129.03 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 129.03384 |
| Heavy Atoms | 9 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 33300-35-5 |
|---|---|
| SMILES | C1=NC(=C(N1)F)C(=O)N |
| InChIKey | GBJBEFBZPYUYIV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-fluoro-1H-imidazole-4-carboxamide (CAS 33300-35-5), with molecular formula C4H4FN3O and molecular weight 129.03 g/mol. IUPAC: 5-fluoro-1H-imidazole-4-carboxamide.
Chemical Property Profile of 5-fluoro-1H-imidazole-4-carboxamide
Property Insights of 5-fluoro-1H-imidazole-4-carboxamide
The XLogP value of -0.9 indicates that 5-fluoro-1H-imidazole-4-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-fluoro-1H-imidazole-4-carboxamide. Following Lipinski's Rule of Five, 5-fluoro-1H-imidazole-4-carboxamide has 2 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 5-fluoro-1H-imidazole-4-carboxamide?
The CAS number of 5-fluoro-1H-imidazole-4-carboxamide is 33300-35-5.
What is the molecular formula of 5-fluoro-1H-imidazole-4-carboxamide?
The molecular formula of 5-fluoro-1H-imidazole-4-carboxamide is C4H4FN3O.
What is the molecular weight of 5-fluoro-1H-imidazole-4-carboxamide?
The molecular weight of 5-fluoro-1H-imidazole-4-carboxamide is 129.03 g/mol.
Where can I buy 5-fluoro-1H-imidazole-4-carboxamide?
You can request a quote for 5-fluoro-1H-imidazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-fluoro-1H-imidazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-fluoro-1H-imidazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.