异烟酰胺1-氧化物
TL;DR: 异烟酰胺1-氧化物 (CAS 38557-82-3) is a chemical compound with molecular formula C6H6N2O2 and molecular weight 138.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异烟酰胺1-氧化物
1-oxidopyridin-1-ium-4-carboxamide
Also Known As: Isonicotinamide 1-oxide, 4-Pyridinecarboxamide 1-Oxide, 4-Carbamoylpyridine 1-oxide, 1-oxidopyridin-1-ium-4-carboxamide, Isonicotinamide oxide
| Molecular Formula | C6H6N2O2 |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 68.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.04292 |
| Heavy Atoms | 10 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 38557-82-3 |
|---|---|
| SMILES | C1=C[N+](=CC=C1C(=O)N)[O-] |
| InChIKey | NZUWTGHVOISMHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异烟酰胺1-氧化物 (CAS 38557-82-3), with molecular formula C6H6N2O2 and molecular weight 138.04 g/mol. IUPAC: 1-oxidopyridin-1-ium-4-carboxamide.
Chemical Property Profile of 异烟酰胺1-氧化物
Property Insights of 异烟酰胺1-氧化物
The XLogP value of -1.3 indicates that 异烟酰胺1-氧化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 异烟酰胺1-氧化物. Following Lipinski's Rule of Five, 异烟酰胺1-氧化物 has 1 hydrogen bond donor(s) and 2 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 异烟酰胺1-氧化物?
The CAS number of 异烟酰胺1-氧化物 is 38557-82-3.
What is the molecular formula of 异烟酰胺1-氧化物?
The molecular formula of 异烟酰胺1-氧化物 is C6H6N2O2.
What is the molecular weight of 异烟酰胺1-氧化物?
The molecular weight of 异烟酰胺1-氧化物 is 138.04 g/mol.
Where can I buy 异烟酰胺1-氧化物?
You can request a quote for 异烟酰胺1-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异烟酰胺1-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 异烟酰胺1-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.