4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-
TL;DR: 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- (CAS 126356-27-2) is a chemical compound with molecular formula C22H32ClNO3 and molecular weight 393.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4R,4aR,8aR)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-ethynyl-2-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol;hydrochloride
Also Known As: 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-, 4-Quinolinol, 1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyldecahydro-2-methyl-, hydrochloride, (2alpha,4beta,4abeta,8aalpha)-, (2R,4R,4aR,8aR)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-ethynyl-2-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol hydrochloride, (2R,4R,4aR,8aR)-1-[2-(3,4-Dimethoxyphenyl)ethyl]-4-ethynyl-2-methyldecahydroquinolin-4-ol--hydrogen chloride (1/1), 1-[2-(3,4-Dimethoxyphenyl)ethyl]-4-ethynyl-2-methyldecahydroquinolin-4-ol--hydrogen chloride (1/1)
| Molecular Formula | C22H32ClNO3 |
|---|---|
| Molecular Weight | 393.21 g/mol |
| LogP | 3.6854 |
| Topological Polar Surface Area | 41.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.20706 |
| Heavy Atoms | 27 |
| Complexity | 674.012 |
Chemical Identifiers
| CAS Number | 126356-27-2 |
|---|---|
| SMILES | C[C@@H]1C[C@@]([C@@H]2CCCC[C@H]2N1CCC3=CC(=C(C=C3)OC)OC)(C#C)O.Cl |
Product Overview
4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- (CAS 126356-27-2), with molecular formula C22H32ClNO3 and molecular weight 393.21 g/mol. IUPAC: (2R,4R,4aR,8aR)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-ethynyl-2-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol;hydrochloride.
Chemical Property Profile of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-
Property Insights of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-
The XLogP value of 3.6854 indicates that 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.93 Ų, 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- has 1 hydrogen bond donor(s) and 4 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 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-?
The CAS number of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- is 126356-27-2.
What is the molecular formula of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-?
The molecular formula of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- is C22H32ClNO3.
What is the molecular weight of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-?
The molecular weight of 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- is 393.21 g/mol.
Where can I buy 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-?
You can request a quote for 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Quinolinol, decahydro-1-(2-(3,4-dimethoxyphenyl)ethyl)-4-ethynyl-2-methyl-, hydrochloride, (2-alpha,4-beta,4a-beta,8a-alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.