3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)
TL;DR: 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) (CAS 83658-39-3) is a chemical compound with molecular formula C24H28N2O9 and molecular weight 488.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3-methoxyphenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethanamine;oxalic acid
Also Known As: 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2), 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-, ethanedioate (1:2), 2-[1-(3-methoxyphenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethanamine; oxalic acid, Oxalic acid--2-[1-(3-methoxyphenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethan-1-amine (2/1), RefChem:280200
| Molecular Formula | C24H28N2O9 |
|---|---|
| Molecular Weight | 488.18 g/mol |
| LogP | 1.7202 |
| Topological Polar Surface Area | 174.03 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.17947 |
| Heavy Atoms | 35 |
| Complexity | 1032.1694 |
Chemical Identifiers
| CAS Number | 83658-39-3 |
|---|---|
| SMILES | CN(C)CCC1CC2=CC=CC=C2C(=N1)C3=CC(=CC=C3)OC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
Product Overview
3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) (CAS 83658-39-3), with molecular formula C24H28N2O9 and molecular weight 488.18 g/mol. IUPAC: 2-[1-(3-methoxyphenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethanamine;oxalic acid.
Chemical Property Profile of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)
Property Insights of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)
The XLogP value of 1.7202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2). The TPSA of 174.03 Ų indicates high polarity, suggesting 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) has 4 hydrogen bond donor(s) and 7 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 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)?
The CAS number of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) is 83658-39-3.
What is the molecular formula of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)?
The molecular formula of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) is C24H28N2O9.
What is the molecular weight of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)?
The molecular weight of 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) is 488.18 g/mol.
Where can I buy 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)?
You can request a quote for 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2)?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-N,N-dimethyl-1-(3-methoxyphenyl)-3-isoquinolineethanamine ethanedioate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.