3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)
TL;DR: 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) (CAS 83658-30-4) is a chemical compound with molecular formula C76H89Cl5F4N8 and molecular weight 1364.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrakis(2-[1-(3-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethanamine);pentahydrochloride
Also Known As: 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5), 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(3-fluorophenyl)-, hydrochloride (4:5), 2-[1-(3-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethanamine pentahydrochloride, RefChem:1068080
| Molecular Formula | C76H89Cl5F4N8 |
|---|---|
| Molecular Weight | 1364.56 g/mol |
| LogP | 16.267 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 1364.5588 |
| Heavy Atoms | 93 |
| Complexity | 3277.46 |
Chemical Identifiers
| CAS Number | 83658-30-4 |
|---|---|
| SMILES | CN(C)CCC1CC2=CC=CC=C2C(=N1)C3=CC(=CC=C3)F.CN(C)CCC1CC2=CC=CC=C2C(=N1)C3=CC(=CC=C3)F.CN(C)CCC1CC2=CC=CC=C2C(=N1)C3=CC(=CC=C3)F.CN(C)CCC1CC2=CC=CC=C2C(=N1)C3=CC(=CC=C3)F.Cl.Cl.Cl.Cl.Cl |
Product Overview
3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) (CAS 83658-30-4), with molecular formula C76H89Cl5F4N8 and molecular weight 1364.56 g/mol. IUPAC: tetrakis(2-[1-(3-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylethanamine);pentahydrochloride.
Chemical Property Profile of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)
Property Insights of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)
The XLogP value of 16.267 indicates that 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5). Following Lipinski's Rule of Five, 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)?
The CAS number of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) is 83658-30-4.
What is the molecular formula of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)?
The molecular formula of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) is C76H89Cl5F4N8.
What is the molecular weight of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)?
The molecular weight of 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) is 1364.56 g/mol.
Where can I buy 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)?
You can request a quote for 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) 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-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5)?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-N,N-dimethyl-1-(3-fluorophenyl)-3-isoquinolineethanamine hydrochloride (4:5) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.