N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide
TL;DR: N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide (CAS 129658-39-5) is a chemical compound with molecular formula C20H36INO2S and molecular weight 481.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(dimethylamino)-3-methylbutan-2-yl]-5-heptylsulfanylbenzene-1,4-diol;hydroiodide
Also Known As: N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide, 1,4-Benzenediol, 2-(1-((dimethylamino)methyl)-2-methylpropyl)-5-(heptylthio)-, hydriodide, 2-(1-((Dimethylamino)methyl)-2-methylpropyl)-5-(heptylthio)-1,4-benzenediol hydriodide, 2-(4-heptylsulfanyl-2,5-dimethoxyphenyl)-N-methylethanamine, 1,4-Benzenediol, 2-(1-((dimethylamino)methyl)-2-methylpropyl)-5-(hepty lthio)-, hydriodide
| Molecular Formula | C20H36INO2S |
|---|---|
| Molecular Weight | 481.15 g/mol |
| LogP | 6.0795 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 481.15115 |
| Heavy Atoms | 25 |
| Complexity | 494.82965 |
Chemical Identifiers
| CAS Number | 129658-39-5 |
|---|---|
| SMILES | CCCCCCCSC1=C(C=C(C(=C1)O)C(CN(C)C)C(C)C)O.I |
Product Overview
N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide (CAS 129658-39-5), with molecular formula C20H36INO2S and molecular weight 481.15 g/mol. IUPAC: 2-[1-(dimethylamino)-3-methylbutan-2-yl]-5-heptylsulfanylbenzene-1,4-diol;hydroiodide.
Chemical Property Profile of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide
Property Insights of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide
The XLogP value of 6.0795 indicates that N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide?
The CAS number of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide is 129658-39-5.
What is the molecular formula of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide?
The molecular formula of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide is C20H36INO2S.
What is the molecular weight of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide?
The molecular weight of N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide is 481.15 g/mol.
Where can I buy N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide?
You can request a quote for N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-2-(4-heptylthio)-2,5-dihydroxyphenyl-3-methylbutylamine hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.