Guaiapate
TL;DR: Guaiapate (CAS 852-42-6) is a chemical compound with molecular formula C18H29NO4 and molecular weight 323.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethyl]piperidine
Also Known As: Guaiapate, Klamar, Guayapato, Guaiapato, Guaiapatum
| Molecular Formula | C18H29NO4 |
|---|---|
| Molecular Weight | 323.21 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 323.20966 |
| Heavy Atoms | 23 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 852-42-6 |
|---|---|
| SMILES | COC1=CC=CC=C1OCCOCCOCCN2CCCCC2 |
| InChIKey | PPVFOZYARYOARE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Guaiapate (CAS 852-42-6), with molecular formula C18H29NO4 and molecular weight 323.21 g/mol. IUPAC: 1-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethyl]piperidine.
Chemical Property Profile of Guaiapate
Property Insights of Guaiapate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guaiapate. With a topological polar surface area (TPSA) of 40.2 Ų, Guaiapate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Guaiapate has 0 hydrogen bond donor(s) and 5 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 Guaiapate?
The CAS number of Guaiapate is 852-42-6.
What is the molecular formula of Guaiapate?
The molecular formula of Guaiapate is C18H29NO4.
What is the molecular weight of Guaiapate?
The molecular weight of Guaiapate is 323.21 g/mol.
Where can I buy Guaiapate?
You can request a quote for Guaiapate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guaiapate?
Yes, KEHONG BIO provides custom synthesis services for Guaiapate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.