1-Bromo-4-methylisoquinolin-3-amine
TL;DR: 1-Bromo-4-methylisoquinolin-3-amine (CAS 2917-63-7) is a chemical compound with molecular formula C10H9BrN2 and molecular weight 235.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-methylisoquinolin-3-amine
Also Known As: 1-bromo-4-methylisoquinolin-3-amine, 3-Isoquinolinamine, 1-bromo-4-methyl-, 1-bromo-3-amino-4-methylisoquinoline, 1-Bromo-4-methylisoquinoline-3-amine, 3-Amino-1-bromo-4-methylisoquinoline
| Molecular Formula | C10H9BrN2 |
|---|---|
| Molecular Weight | 235.99 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 235.9949 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 2917-63-7 |
|---|---|
| SMILES | CC1=C(N=C(C2=CC=CC=C12)Br)N |
| InChIKey | YCVJUPIKBPADHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-4-methylisoquinolin-3-amine (CAS 2917-63-7), with molecular formula C10H9BrN2 and molecular weight 235.99 g/mol. IUPAC: 1-bromo-4-methylisoquinolin-3-amine.
Chemical Property Profile of 1-Bromo-4-methylisoquinolin-3-amine
Property Insights of 1-Bromo-4-methylisoquinolin-3-amine
The XLogP value of 3.1 indicates that 1-Bromo-4-methylisoquinolin-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.9 Ų, 1-Bromo-4-methylisoquinolin-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-4-methylisoquinolin-3-amine has 1 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 1-Bromo-4-methylisoquinolin-3-amine?
The CAS number of 1-Bromo-4-methylisoquinolin-3-amine is 2917-63-7.
What is the molecular formula of 1-Bromo-4-methylisoquinolin-3-amine?
The molecular formula of 1-Bromo-4-methylisoquinolin-3-amine is C10H9BrN2.
What is the molecular weight of 1-Bromo-4-methylisoquinolin-3-amine?
The molecular weight of 1-Bromo-4-methylisoquinolin-3-amine is 235.99 g/mol.
Where can I buy 1-Bromo-4-methylisoquinolin-3-amine?
You can request a quote for 1-Bromo-4-methylisoquinolin-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-4-methylisoquinolin-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-4-methylisoquinolin-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.