2-Methylthio-4,5-dimethoxyamphetamine
TL;DR: 2-Methylthio-4,5-dimethoxyamphetamine (CAS 79440-51-0) is a chemical compound with molecular formula C12H19NO2S and molecular weight 241.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dimethoxy-2-methylsulfanylphenyl)propan-2-amine
Also Known As: Ortho-DOT, 2-methylthio-4,5-dimethoxyamphetamine, 4,5-DIMETHOXY-2-METHYLTHIOAMPHETAMINE, Benzeneethanamine, 2-methylthio-4,5-dimethoxy-alpha-methyl-, 1-(4,5-dimethoxy-2-methylsulfanylphenyl)propan-2-amine
| Molecular Formula | C12H19NO2S |
|---|---|
| Molecular Weight | 241.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 69.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 241.11365 |
| Heavy Atoms | 16 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 79440-51-0 |
|---|---|
| SMILES | CC(CC1=CC(=C(C=C1SC)OC)OC)N |
| InChIKey | GQUWSNDODZTHKC-UHFFFAOYSA-N |
Product Overview
2-Methylthio-4,5-dimethoxyamphetamine (CAS 79440-51-0), with molecular formula C12H19NO2S and molecular weight 241.11 g/mol. IUPAC: 1-(4,5-dimethoxy-2-methylsulfanylphenyl)propan-2-amine.
Chemical Property Profile of 2-Methylthio-4,5-dimethoxyamphetamine
Property Insights of 2-Methylthio-4,5-dimethoxyamphetamine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylthio-4,5-dimethoxyamphetamine. The TPSA of 69.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylthio-4,5-dimethoxyamphetamine. Following Lipinski's Rule of Five, 2-Methylthio-4,5-dimethoxyamphetamine 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 2-Methylthio-4,5-dimethoxyamphetamine?
The CAS number of 2-Methylthio-4,5-dimethoxyamphetamine is 79440-51-0.
What is the molecular formula of 2-Methylthio-4,5-dimethoxyamphetamine?
The molecular formula of 2-Methylthio-4,5-dimethoxyamphetamine is C12H19NO2S.
What is the molecular weight of 2-Methylthio-4,5-dimethoxyamphetamine?
The molecular weight of 2-Methylthio-4,5-dimethoxyamphetamine is 241.11 g/mol.
Where can I buy 2-Methylthio-4,5-dimethoxyamphetamine?
You can request a quote for 2-Methylthio-4,5-dimethoxyamphetamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylthio-4,5-dimethoxyamphetamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylthio-4,5-dimethoxyamphetamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.