![3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide structure](/static/products/1428/142808-57-9.webp)
3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide
TL;DR: 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide (CAS 142808-57-9) is a chemical compound with molecular formula C21H22INO3 and molecular weight 463.06445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide
Also Known As: Piperidinium,3,5-bis[(4-hydroxyphenyl)methylene]-1,1-dimethyl-4-oxo-, iodide (1:1), 3,5-Bis((4-hydroxyphenyl)methylene)-1,1-dimethyl-4-oxo-piperidinium iodide
Technical Specifications
| Molecular Formula | C21H22INO3 |
| Molecular Weight | 463.06445 g/mol |
| XLogP | 0.2279 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 463.06445 Da |
| Heavy Atoms | 26 |
| Complexity | 501.0 |
| SMILES | C[N+]1(CC(=CC2=CC=C(C=C2)O)C(=O)C(=CC3=CC=C(C=C3)O)C1)C.[I-] |
| InChIKey | DDKVAMNBVMNGKI-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide
Property Insights of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide
The XLogP value of 0.2279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide. With a topological polar surface area (TPSA) of 57.5 Ų, 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide?
The CAS number of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide is 142808-57-9.
What is the molecular formula of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide?
The molecular formula of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide is C21H22INO3.
What is the molecular weight of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide?
The molecular weight of 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide is 463.06445 g/mol.
Where can I buy 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide?
You can request a quote for 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide?
Yes, CoreyChem provides custom synthesis services for 3,5-Bis[(4-hydroxyphenyl)methylidene]-1,1-dimethylpiperidin-1-ium-4-one iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.