RefChem:280207
TL;DR: RefChem:280207 (CAS 83658-13-3) is a chemical compound with molecular formula C18H20Cl3FN2 and molecular weight 388.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[7-chloro-1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine;dihydrochloride
Also Known As: 1-(7-Chloro-1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl)-N,N-dimethylmethanamine dihydrochloride, 3-Isoquinolinemethanamine, 3,4-dihydro-7-chloro-N,N-dimethyl-1-(2-fluorophenyl)-, hydrochloride, hydrate (1:2:1), 1-[7-CHLORO-1-(2-FLUOROPHENYL)-3,4-DIHYDROISOQUINOLIN-3-YL]-N,N-DIMETHYL-METHANAMINE DIHYDROCHLORIDE, 1-[7-chloro-1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine dihydrochloride, 1-[7-chloro-1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine,dihydrochloride
| Molecular Formula | C18H20Cl3FN2 |
|---|---|
| Molecular Weight | 388.07 g/mol |
| LogP | 4.6464 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.0676 |
| Heavy Atoms | 24 |
| Complexity | 731.95386 |
Chemical Identifiers
| CAS Number | 83658-13-3 |
|---|---|
| SMILES | CN(C)CC1CC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F.Cl.Cl |
Product Overview
RefChem:280207 (CAS 83658-13-3), with molecular formula C18H20Cl3FN2 and molecular weight 388.07 g/mol. IUPAC: 1-[7-chloro-1-(2-fluorophenyl)-3,4-dihydroisoquinolin-3-yl]-N,N-dimethylmethanamine;dihydrochloride.
Chemical Property Profile of RefChem:280207
Property Insights of RefChem:280207
The XLogP value of 4.6464 indicates that RefChem:280207 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, RefChem:280207 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:280207 has 0 hydrogen bond donor(s) and 2 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 RefChem:280207?
The CAS number of RefChem:280207 is 83658-13-3.
What is the molecular formula of RefChem:280207?
The molecular formula of RefChem:280207 is C18H20Cl3FN2.
What is the molecular weight of RefChem:280207?
The molecular weight of RefChem:280207 is 388.07 g/mol.
Where can I buy RefChem:280207?
You can request a quote for RefChem:280207 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:280207?
Yes, KEHONG BIO provides custom synthesis services for RefChem:280207 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.