Isoxazole-5-carboxamide
TL;DR: Isoxazole-5-carboxamide (CAS 89032-77-9) is a chemical compound with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-oxazole-5-carboxamide
Also Known As: isoxazole-5-carboxamide, 1,2-oxazole-5-carboxamide, 5-Isoxazolecarboxamide, 5-Isoxazolecarboxamide (7CI, 9CI), JBN
| Molecular Formula | C4H4N2O2 |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | -0.2265 |
| Topological Polar Surface Area | 69.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.027275 |
| Heavy Atoms | 8 |
| Complexity | 179.92819 |
Chemical Identifiers
| CAS Number | 89032-77-9 |
|---|---|
| SMILES | C1=C(ON=C1)C(=O)N |
Product Overview
Isoxazole-5-carboxamide (CAS 89032-77-9), with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol. IUPAC: 1,2-oxazole-5-carboxamide.
Chemical Property Profile of Isoxazole-5-carboxamide
Property Insights of Isoxazole-5-carboxamide
The XLogP value of -0.2265 indicates that Isoxazole-5-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoxazole-5-carboxamide. Following Lipinski's Rule of Five, Isoxazole-5-carboxamide has 1 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 Isoxazole-5-carboxamide?
The CAS number of Isoxazole-5-carboxamide is 89032-77-9.
What is the molecular formula of Isoxazole-5-carboxamide?
The molecular formula of Isoxazole-5-carboxamide is C4H4N2O2.
What is the molecular weight of Isoxazole-5-carboxamide?
The molecular weight of Isoxazole-5-carboxamide is 112.03 g/mol.
Where can I buy Isoxazole-5-carboxamide?
You can request a quote for Isoxazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.