TL;DR: 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide (CAS 1035495-75-0) is a chemical compound with molecular formula C15H29IN2O2 and molecular weight 396.12738 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-hydroxyimino-8-(1-methylazepan-1-ium-1-yl)octan-2-one iodide
Also Known As: 1-[(8E)-8-(HYDROXYIMINO)-7-OXOOCTYL]-1-METHYLAZEPAN-1-IUM IODIDE
| Molecular Formula | C15H29IN2O2 |
| Molecular Weight | 396.12738 g/mol |
| XLogP | -0.0094 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 396.12738 Da |
| Heavy Atoms | 20 |
| Complexity | 282.0 |
| SMILES | C[N+]1(CCCCCC1)CCCCCCC(=O)C=NO.[I-] |
| InChIKey | XRRCBEUGTWEYMG-UHFFFAOYSA-N |
The XLogP value of -0.0094 indicates that 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.7 Ų, 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide is 1035495-75-0.
The molecular formula of 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide is C15H29IN2O2.
The molecular weight of 1-[(8E)-8-(Hydroxyimino)-7-oxooctyl]-1-methylazepan-1-ium iodide is 396.12738 g/mol.
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