1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido
TL;DR: 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido (CAS 98347-93-4) is a chemical compound with molecular formula C17H26INO and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-1-methyl-4-phenylpiperidin-1-ium-4-carbaldehyde iodide
Also Known As: 1-Butyl-4-formyl-1-methyl-4-phenylpiperidinium iodide, 2992 I.S., 2992 I.S, Piperidinium, 1-butyl-4-formyl-1-methyl-4-phenyl-, iodide, 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido
| Molecular Formula | C17H26INO |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 0.1678 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.1059 |
| Heavy Atoms | 20 |
| Complexity | 410.258 |
Chemical Identifiers
| CAS Number | 98347-93-4 |
|---|---|
| SMILES | CCCC[N+]1(CCC(CC1)(C=O)C2=CC=CC=C2)C.[I-] |
Product Overview
1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido (CAS 98347-93-4), with molecular formula C17H26INO and molecular weight 387.11 g/mol. IUPAC: 1-butyl-1-methyl-4-phenylpiperidin-1-ium-4-carbaldehyde iodide.
Chemical Property Profile of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido
Property Insights of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido
The XLogP value of 0.1678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido. With a topological polar surface area (TPSA) of 17.07 Ų, 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido?
The CAS number of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido is 98347-93-4.
What is the molecular formula of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido?
The molecular formula of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido is C17H26INO.
What is the molecular weight of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido?
The molecular weight of 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido is 387.11 g/mol.
Where can I buy 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido?
You can request a quote for 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyl-4-formyl-1-methyl-4-phenylpiperidin-1-iumato iodido and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.