TL;DR: Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide (CAS 30321-83-6) is a chemical compound with molecular formula C16H22IN3O and molecular weight 399.08075 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-[2-(5-methyl-6-oxo-3-phenylpyridazin-1-yl)ethyl]azanium iodide
Also Known As: AG 261, AMMONIUM, (2-(4-METHYL-3-OXO-6-PHENYL-2-(2H)PYRIDAZINYL)ETHYL)TRIMETHYL-, IODIDE, 3(2H)Pyrazinone, 2-(2-dimethylaminoethyl)-4-methyl-6-phenyl-, methiodide, trimethyl-[2-(5-methyl-6-oxo-3-phenylpyridazin-1-yl)ethyl]azanium iodide, Ammonium, trimethyl(2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)-, iodide
| Molecular Formula | C16H22IN3O |
| Molecular Weight | 399.08075 g/mol |
| XLogP | -1.07 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.08075 Da |
| Heavy Atoms | 21 |
| Complexity | 425.0 |
| SMILES | CC1=CC(=NN(C1=O)CC[N+](C)(C)C)C2=CC=CC=C2.[I-] |
| InChIKey | NIKJHKJWKJJJDF-UHFFFAOYSA-M |
The XLogP value of -1.07 indicates that Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.7 Ų, Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide is 30321-83-6.
The molecular formula of Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide is C16H22IN3O.
The molecular weight of Ammonium, (2-(4-methyl-3-oxo-6-phenyl-2-(2H)pyridazinyl)ethyl)trimethyl-, iodide is 399.08075 g/mol.
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