TL;DR: (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid (CAS 1419882-43-1) is a chemical compound with molecular formula C10H9N3O4 and molecular weight 235.05931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-4-oxo-4-[2-(pyridine-3-carbonyl)hydrazinyl]but-2-enoic acid
Also Known As: (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid, J3.157.598B, 4-Oxo-4-[2-(3-pyridinylcarbonyl)hydrazino]-2-butenoic acid, (2E)-4-OXO-4-[(PYRIDIN-3-YL)FORMOHYDRAZIDO]BUT-2-ENOIC ACID, (2E)-4-oxo-4-[2-(pyridin-3-ylcarbonyl)hydrazinyl]but-2-enoic acid
| Molecular Formula | C10H9N3O4 |
| Molecular Weight | 235.05931 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.05931 Da |
| Heavy Atoms | 17 |
| Complexity | 340.0 |
| SMILES | C1=CC(=CN=C1)C(=O)NNC(=O)/C=C/C(=O)O |
| InChIKey | PMTJSWVYLYQGEU-ONEGZZNKSA-N |
The XLogP value of -0.7 indicates that (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid. Following Lipinski's Rule of Five, (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid is 1419882-43-1.
The molecular formula of (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid is C10H9N3O4.
The molecular weight of (E)-4-(2-Nicotinoylhydrazinyl)-4-Oxobut-2-Enoic Acid is 235.05931 g/mol.
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