N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)
TL;DR: N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) (CAS 83658-12-2) is a chemical compound with molecular formula C20H21FN2O4 and molecular weight 372.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine;oxalic acid
Also Known As: N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1), 3-Isoquinolinemethanamine, 3,4-dihydro-N,N-dimethyl-1-(2-fluorophenyl)-, ethanedioate (1:1), 1-(1-(2-Fluorophenyl)-3,4-dihydroisoquinolin-3-yl)-N,N-dimethylmethanamine oxalate, 3-Isoquinolinemethanamine,3,4-dihydro-N,N-dimethyl-1- -,ethanedioate, 1-[1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine,oxalic acid
| Molecular Formula | C20H21FN2O4 |
|---|---|
| Molecular Weight | 372.15 g/mol |
| LogP | 2.305 |
| Topological Polar Surface Area | 90.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.14853 |
| Heavy Atoms | 27 |
| Complexity | 852.5651 |
Chemical Identifiers
| CAS Number | 83658-12-2 |
|---|---|
| SMILES | CN(C)CC1CC2=CC=CC=C2C(=N1)C3=CC=CC=C3F.C(=O)(C(=O)O)O |
Product Overview
N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) (CAS 83658-12-2), with molecular formula C20H21FN2O4 and molecular weight 372.15 g/mol. IUPAC: 1-[1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine;oxalic acid.
Chemical Property Profile of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)
Property Insights of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)
The XLogP value of 2.305 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1). The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1). Following Lipinski's Rule of Five, N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) has 2 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 N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)?
The CAS number of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) is 83658-12-2.
What is the molecular formula of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)?
The molecular formula of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) is C20H21FN2O4.
What is the molecular weight of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)?
The molecular weight of N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) is 372.15 g/mol.
Where can I buy N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)?
You can request a quote for N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) 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-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-1-(2-fluorophenyl)-3,4-dihydro-3-isoquinolinemethanamine ethanedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.