4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine
TL;DR: 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine (CAS 31309-66-7) is a chemical compound with molecular formula C15H12BrN3 and molecular weight 313.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-aminophenyl)-1-bromoisoquinolin-3-amine
Also Known As: 4-(4-aminophenyl)-1-bromoisoquinolin-3-amine, 3-ISOQUINOLINAMINE,4-(4-AMINOPHENYL)-1-BROMO-
| Molecular Formula | C15H12BrN3 |
|---|---|
| Molecular Weight | 313.02 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.02145 |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 31309-66-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N=C2Br)N)C3=CC=C(C=C3)N |
| InChIKey | QOLPUXGNCDMERI-UHFFFAOYSA-N |
Product Overview
4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine (CAS 31309-66-7), with molecular formula C15H12BrN3 and molecular weight 313.02 g/mol. IUPAC: 4-(4-aminophenyl)-1-bromoisoquinolin-3-amine.
Chemical Property Profile of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine
Property Insights of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine
The XLogP value of 3.7 indicates that 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine. Following Lipinski's Rule of Five, 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine has 2 hydrogen bond donor(s) and 3 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 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine?
The CAS number of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine is 31309-66-7.
What is the molecular formula of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine?
The molecular formula of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine is C15H12BrN3.
What is the molecular weight of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine?
The molecular weight of 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine is 313.02 g/mol.
Where can I buy 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine?
You can request a quote for 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Aminophenyl)-1-bromoisoquinolin-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.