4-羟基吡啶-3-甲酸N-氧化物
TL;DR: 4-羟基吡啶-3-甲酸N-氧化物 (CAS 501688-67-1) is a chemical compound with molecular formula C6H5NO4 and molecular weight 155.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-羟基吡啶-3-甲酸N-氧化物
1-hydroxy-4-oxopyridine-3-carboxylic acid
Also Known As: 1-hydroxy-4-oxopyridine-3-carboxylic acid, 3-Pyridinecarboxylic acid, N-oxide, 4-hydroxy-, 3-pyridinecarboxylic acid,1,4-dihydro-1-hydroxy-4-oxo-, 3-PYRIDINECARBOXYLIC ACID, 1,4-DIHYDRO-1-HYDROXY-4-OXO-, 3-Pyridinecarboxylic acid, 1,4-dihydro-1-hydroxy-4-oxo- (9CI)
| Molecular Formula | C6H5NO4 |
|---|---|
| Molecular Weight | 155.02 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.02185 |
| Heavy Atoms | 11 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 501688-67-1 |
|---|---|
| SMILES | C1=CN(C=C(C1=O)C(=O)O)O |
| InChIKey | GSWQIHLVBXOIIY-UHFFFAOYSA-N |
Product Overview
4-羟基吡啶-3-甲酸N-氧化物 (CAS 501688-67-1), with molecular formula C6H5NO4 and molecular weight 155.02 g/mol. IUPAC: 1-hydroxy-4-oxopyridine-3-carboxylic acid.
Chemical Property Profile of 4-羟基吡啶-3-甲酸N-氧化物
Property Insights of 4-羟基吡啶-3-甲酸N-氧化物
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-羟基吡啶-3-甲酸N-氧化物. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-羟基吡啶-3-甲酸N-氧化物. Following Lipinski's Rule of Five, 4-羟基吡啶-3-甲酸N-氧化物 has 2 hydrogen bond donor(s) and 5 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 4-羟基吡啶-3-甲酸N-氧化物?
The CAS number of 4-羟基吡啶-3-甲酸N-氧化物 is 501688-67-1.
What is the molecular formula of 4-羟基吡啶-3-甲酸N-氧化物?
The molecular formula of 4-羟基吡啶-3-甲酸N-氧化物 is C6H5NO4.
What is the molecular weight of 4-羟基吡啶-3-甲酸N-氧化物?
The molecular weight of 4-羟基吡啶-3-甲酸N-氧化物 is 155.02 g/mol.
Where can I buy 4-羟基吡啶-3-甲酸N-氧化物?
You can request a quote for 4-羟基吡啶-3-甲酸N-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 4-羟基吡啶-3-甲酸N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-羟基吡啶-3-甲酸N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.