5-LI-O-Me-3, 2-HOPO
TL;DR: 5-LI-O-Me-3, 2-HOPO (CAS 165543-97-5) is a chemical compound with molecular formula C18H22N4O7 and molecular weight 406.14883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-N-[2-[2-[(3-hydroxy-1-methyl-2-oxopyridine-4-carbonyl)amino]ethoxy]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
Also Known As: 5-LI-O-Me-3, 2-HOPO, 5-LIO (Me-3, 2-HOPO), NCI60_032920, J1.402.895A, 3-hydroxy-N-[2-[2-[(3-hydroxy-1-methyl-2-oxo-pyridine-4-carbonyl)amino]ethoxy]ethyl]-1-methyl-2-oxo-pyridine-4-carboxamide
Technical Specifications
| Molecular Formula | C18H22N4O7 |
| Molecular Weight | 406.14883 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 406.14883 Da |
| Heavy Atoms | 29 |
| Complexity | 773.0 |
| SMILES | CN1C=CC(=C(C1=O)O)C(=O)NCCOCCNC(=O)C2=C(C(=O)N(C=C2)C)O |
| InChIKey | UJBLQXIGCCWUTB-UHFFFAOYSA-N |
Chemical Property Profile of 5-LI-O-Me-3, 2-HOPO
Property Insights of 5-LI-O-Me-3, 2-HOPO
The XLogP value of -0.8 indicates that 5-LI-O-Me-3, 2-HOPO is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.0 Ų indicates high polarity, suggesting 5-LI-O-Me-3, 2-HOPO may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-LI-O-Me-3, 2-HOPO has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-LI-O-Me-3, 2-HOPO?
The CAS number of 5-LI-O-Me-3, 2-HOPO is 165543-97-5.
What is the molecular formula of 5-LI-O-Me-3, 2-HOPO?
The molecular formula of 5-LI-O-Me-3, 2-HOPO is C18H22N4O7.
What is the molecular weight of 5-LI-O-Me-3, 2-HOPO?
The molecular weight of 5-LI-O-Me-3, 2-HOPO is 406.14883 g/mol.
Where can I buy 5-LI-O-Me-3, 2-HOPO?
You can request a quote for 5-LI-O-Me-3, 2-HOPO directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-LI-O-Me-3, 2-HOPO?
Yes, CoreyChem provides custom synthesis services for 5-LI-O-Me-3, 2-HOPO and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.