Quinacainol
TL;DR: Quinacainol (CAS 86073-85-0) is a chemical compound with molecular formula C21H30N2O and molecular weight 326.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-tert-butylquinolin-4-yl)-3-piperidin-4-ylpropan-1-ol
Also Known As: QUINACAINOL, Quinacainolum, Quinacainol [INN], PK 10139, RP 54272
| Molecular Formula | C21H30N2O |
|---|---|
| Molecular Weight | 326.24 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 45.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.2358 |
| Heavy Atoms | 24 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 86073-85-0 |
|---|---|
| SMILES | CC(C)(C)C1=NC2=CC=CC=C2C(=C1)C(CCC3CCNCC3)O |
| InChIKey | OPNPUTUBENWDBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Quinacainol (CAS 86073-85-0), with molecular formula C21H30N2O and molecular weight 326.24 g/mol. IUPAC: 1-(2-tert-butylquinolin-4-yl)-3-piperidin-4-ylpropan-1-ol.
Chemical Property Profile of Quinacainol
Property Insights of Quinacainol
The XLogP value of 4.1 indicates that Quinacainol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.2 Ų, Quinacainol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinacainol has 2 hydrogen bond donor(s) and 3 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 Quinacainol?
The CAS number of Quinacainol is 86073-85-0.
What is the molecular formula of Quinacainol?
The molecular formula of Quinacainol is C21H30N2O.
What is the molecular weight of Quinacainol?
The molecular weight of Quinacainol is 326.24 g/mol.
Where can I buy Quinacainol?
You can request a quote for Quinacainol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinacainol?
Yes, KEHONG BIO provides custom synthesis services for Quinacainol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.