alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride
TL;DR: alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride (CAS 131961-52-9) is a chemical compound with molecular formula C13H22ClNO2S and molecular weight 291.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(dimethylamino)ethoxy]-1-(4-methylsulfanylphenyl)ethanol;hydrochloride
Also Known As: alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride, Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-4-(methylthio)-, hydrochloride, 2-[2-(dimethylamino)ethoxy]-1-(4-methylsulfanylphenyl)ethano, Benzenemethanol, a-[[2-(dimethylamino)ethoxy]methyl]-4-(methylthio)-,hydrochloride (1:1), 2-(2-dimethylaminoethyloxy)-1-(4-methylsulfanylphenyl)ethanol hydrochloride
| Molecular Formula | C13H22ClNO2S |
|---|---|
| Molecular Weight | 291.11 g/mol |
| LogP | 2.4419 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.106 |
| Heavy Atoms | 18 |
| Complexity | 319.27222 |
Chemical Identifiers
| CAS Number | 131961-52-9 |
|---|---|
| SMILES | CN(C)CCOCC(C1=CC=C(C=C1)SC)O.Cl |
Product Overview
alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride (CAS 131961-52-9), with molecular formula C13H22ClNO2S and molecular weight 291.11 g/mol. IUPAC: 2-[2-(dimethylamino)ethoxy]-1-(4-methylsulfanylphenyl)ethanol;hydrochloride.
Chemical Property Profile of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride
Property Insights of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride
The XLogP value of 2.4419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride. With a topological polar surface area (TPSA) of 32.7 Ų, alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride 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 alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride?
The CAS number of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride is 131961-52-9.
What is the molecular formula of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride?
The molecular formula of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride is C13H22ClNO2S.
What is the molecular weight of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride?
The molecular weight of alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride is 291.11 g/mol.
Where can I buy alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride?
You can request a quote for alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for alpha-((2-(Dimethylamino)ethoxy)methyl)-4-(methylthio)benzenemethanol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.