3-Bromoisoquinolin-1-amine
TL;DR: 3-Bromoisoquinolin-1-amine (CAS 40073-36-7) is a chemical compound with molecular formula C9H7BrN2 and molecular weight 221.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromoisoquinolin-1-amine
Also Known As: 3-bromoisoquinolin-1-amine, 1-Isoquinolinamine, 3-bromo-, 3-Bromo-1-isoquinolinamine, 1-Amino-3-bromoisoquinoline, 3-bromo-1-isoquinolinylamine
| Molecular Formula | C9H7BrN2 |
|---|---|
| Molecular Weight | 221.98 g/mol |
| LogP | 2.5795 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 221.97926 |
| Heavy Atoms | 12 |
| Complexity | 425.7981 |
Chemical Identifiers
| CAS Number | 40073-36-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(N=C2N)Br |
Product Overview
3-Bromoisoquinolin-1-amine (CAS 40073-36-7), with molecular formula C9H7BrN2 and molecular weight 221.98 g/mol. IUPAC: 3-bromoisoquinolin-1-amine.
Chemical Property Profile of 3-Bromoisoquinolin-1-amine
Property Insights of 3-Bromoisoquinolin-1-amine
The XLogP value of 2.5795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromoisoquinolin-1-amine. With a topological polar surface area (TPSA) of 38.91 Ų, 3-Bromoisoquinolin-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromoisoquinolin-1-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 3-Bromoisoquinolin-1-amine?
The CAS number of 3-Bromoisoquinolin-1-amine is 40073-36-7.
What is the molecular formula of 3-Bromoisoquinolin-1-amine?
The molecular formula of 3-Bromoisoquinolin-1-amine is C9H7BrN2.
What is the molecular weight of 3-Bromoisoquinolin-1-amine?
The molecular weight of 3-Bromoisoquinolin-1-amine is 221.98 g/mol.
Where can I buy 3-Bromoisoquinolin-1-amine?
You can request a quote for 3-Bromoisoquinolin-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromoisoquinolin-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromoisoquinolin-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.