RefChem:1091385
TL;DR: RefChem:1091385 (CAS 25517-07-1) is a chemical compound with molecular formula C18H31IN2O and molecular weight 418.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-2-(1-methylpiperidin-1-ium-1-yl)acetamide iodide
Also Known As: 1-((1-Adamantylcarbamoyl)methyl)-1-methylpiperidinium iodide, Piperidinium, 1-((1-adamantylcarbamoyl)methyl)-1-methyl-, iodide, N-(1-adamantyl)-2-(1-methylpiperidin-1-ium-1-yl)acetamide iodide, N-(1-adamantyl)-2-(1-methylpiperidin-1-ium-1-yl)acetamide,iodide, N-(Adamantan-1-yl)-2-(1-methylpiperidin-1-ium-1-yl)ethanimidate--hydrogen iodide (1/1)
| Molecular Formula | C18H31IN2O |
|---|---|
| Molecular Weight | 418.15 g/mol |
| LogP | -0.29 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.1481 |
| Heavy Atoms | 22 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 25517-07-1 |
|---|---|
| SMILES | C[N+]1(CCCCC1)CC(=O)NC23CC4CC(C2)CC(C4)C3.[I-] |
| InChIKey | RMNHATXITZKMLK-UHFFFAOYSA-N |
Product Overview
RefChem:1091385 (CAS 25517-07-1), with molecular formula C18H31IN2O and molecular weight 418.15 g/mol. IUPAC: N-(1-adamantyl)-2-(1-methylpiperidin-1-ium-1-yl)acetamide iodide.
Chemical Property Profile of RefChem:1091385
Property Insights of RefChem:1091385
The XLogP value of -0.29 indicates that RefChem:1091385 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.1 Ų, RefChem:1091385 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1091385 has 1 hydrogen bond donor(s) and 2 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 RefChem:1091385?
The CAS number of RefChem:1091385 is 25517-07-1.
What is the molecular formula of RefChem:1091385?
The molecular formula of RefChem:1091385 is C18H31IN2O.
What is the molecular weight of RefChem:1091385?
The molecular weight of RefChem:1091385 is 418.15 g/mol.
Where can I buy RefChem:1091385?
You can request a quote for RefChem:1091385 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1091385?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1091385 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.