1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine
TL;DR: 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine (CAS 338953-28-9) is a chemical compound with molecular formula C15H9BrClFN2 and molecular weight 349.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-8-chloro-4-(4-fluorophenyl)isoquinolin-3-amine
Also Known As: Bionet1_001610, 1-bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine, 1-bromo-8-chloro-4-(4-fluorophenyl)isoquinolin-3-amine, 5H-029
| Molecular Formula | C15H9BrClFN2 |
|---|---|
| Molecular Weight | 349.96 g/mol |
| LogP | 5.039 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 349.96216 |
| Heavy Atoms | 20 |
| Complexity | 803.0728 |
Chemical Identifiers
| CAS Number | 338953-28-9 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)C(=NC(=C2C3=CC=C(C=C3)F)N)Br |
Product Overview
1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine (CAS 338953-28-9), with molecular formula C15H9BrClFN2 and molecular weight 349.96 g/mol. IUPAC: 1-bromo-8-chloro-4-(4-fluorophenyl)isoquinolin-3-amine.
Chemical Property Profile of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine
Property Insights of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine
The XLogP value of 5.039 indicates that 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.91 Ų, 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine?
The CAS number of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine is 338953-28-9.
What is the molecular formula of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine?
The molecular formula of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine is C15H9BrClFN2.
What is the molecular weight of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine?
The molecular weight of 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine is 349.96 g/mol.
Where can I buy 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine?
You can request a quote for 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-8-chloro-4-(4-fluorophenyl)-3-isoquinolinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.