N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate
TL;DR: N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate (CAS 128959-27-3) is a chemical compound with molecular formula C20H25NO6S and molecular weight 407.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N-methylpropan-2-amine;oxalic acid
Also Known As: N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate, 2-((3,4-Dimethoxyphenyl)thio)-N,alpha-dimethylbenzeneethanamine ethanedioate (1:1), Benzeneethanamine, 2-((3,4-dimethoxyphenyl)thio)-N,alpha-dimethyl-, ethanedioate (1:1), 1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N-methylpropan-2-amine;oxalic acid, 1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N-methylpropan-2-amine; oxalic acid
| Molecular Formula | C20H25NO6S |
|---|---|
| Molecular Weight | 407.14 g/mol |
| LogP | 3.161 |
| Topological Polar Surface Area | 105.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.14026 |
| Heavy Atoms | 28 |
| Complexity | 784.01544 |
Chemical Identifiers
| CAS Number | 128959-27-3 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1SC2=CC(=C(C=C2)OC)OC)NC.C(=O)(C(=O)O)O |
Product Overview
N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate (CAS 128959-27-3), with molecular formula C20H25NO6S and molecular weight 407.14 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N-methylpropan-2-amine;oxalic acid.
Chemical Property Profile of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate
Property Insights of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate
The XLogP value of 3.161 indicates that N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate. Following Lipinski's Rule of Five, N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate has 3 hydrogen bond donor(s) and 6 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 N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate?
The CAS number of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate is 128959-27-3.
What is the molecular formula of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate?
The molecular formula of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate is C20H25NO6S.
What is the molecular weight of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate?
The molecular weight of N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate is 407.14 g/mol.
Where can I buy N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate?
You can request a quote for N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-1-(2-(3,4-dimethoxyphenylthio)phenyl)-2-propylamine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.