Quinacainol hydrochloride
TL;DR: Quinacainol hydrochloride (CAS 83255-74-7) is a chemical compound with molecular formula C21H32Cl2N2O and molecular weight 398.19 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;dihydrochloride
Also Known As: Quinacainol hydrochloride, Quinacainol (dihydrochloride), (+-)-1-(2-(1,1-Dimethylethyl)-4-quinolyl)-3-(4-piperidyl)-1-propanol dihydrochloride, 4-Quinolinemethanol, 2-(1,1-dimethylethyl)-alpha-(2-(4-piperidinyl)ethyl)-, dihydrochloride, (+-)-, 1-(2-tert-Butylquinolin-4-yl)-3-(piperidin-4-yl)propan-1-ol--hydrogen chloride (1/2)
| Molecular Formula | C21H32Cl2N2O |
|---|---|
| Molecular Weight | 398.19 g/mol |
| LogP | 5.1891 |
| Topological Polar Surface Area | 45.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.18918 |
| Heavy Atoms | 26 |
| Complexity | 693.9608 |
Chemical Identifiers
| CAS Number | 83255-74-7 |
|---|---|
| SMILES | CC(C)(C)C1=NC2=CC=CC=C2C(=C1)C(CCC3CCNCC3)O.Cl.Cl |
Product Overview
Quinacainol hydrochloride (CAS 83255-74-7), with molecular formula C21H32Cl2N2O and molecular weight 398.19 g/mol. IUPAC: 1-(2-tert-butylquinolin-4-yl)-3-piperidin-4-ylpropan-1-ol;dihydrochloride.
Chemical Property Profile of Quinacainol hydrochloride
Property Insights of Quinacainol hydrochloride
The XLogP value of 5.1891 indicates that Quinacainol hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.15 Ų, Quinacainol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinacainol hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quinacainol hydrochloride?
The CAS number of Quinacainol hydrochloride is 83255-74-7.
What is the molecular formula of Quinacainol hydrochloride?
The molecular formula of Quinacainol hydrochloride is C21H32Cl2N2O.
What is the molecular weight of Quinacainol hydrochloride?
The molecular weight of Quinacainol hydrochloride is 398.19 g/mol.
Where can I buy Quinacainol hydrochloride?
You can request a quote for Quinacainol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinacainol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Quinacainol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.