3-(2-Methylphenyl)isoquinolin-1-amine
TL;DR: 3-(2-Methylphenyl)isoquinolin-1-amine (CAS 23023-38-3) is a chemical compound with molecular formula C16H14N2 and molecular weight 234.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenyl)isoquinolin-1-amine
Also Known As: 3-(2-methylphenyl)isoquinolin-1-amine, 1-Amino-3-(2-methylphenyl)isoquinoline, 3-(2-methylphenyl)-1-isoquinolinylamine, J2.038.262G, AM-814/41094997
| Molecular Formula | C16H14N2 |
|---|---|
| Molecular Weight | 234.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 38.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.11569 |
| Heavy Atoms | 18 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 23023-38-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=CC3=CC=CC=C3C(=N2)N |
| InChIKey | FMPKUGLILJSAJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Methylphenyl)isoquinolin-1-amine (CAS 23023-38-3), with molecular formula C16H14N2 and molecular weight 234.12 g/mol. IUPAC: 3-(2-methylphenyl)isoquinolin-1-amine.
Chemical Property Profile of 3-(2-Methylphenyl)isoquinolin-1-amine
Property Insights of 3-(2-Methylphenyl)isoquinolin-1-amine
The XLogP value of 3.8 indicates that 3-(2-Methylphenyl)isoquinolin-1-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, 3-(2-Methylphenyl)isoquinolin-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methylphenyl)isoquinolin-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-(2-Methylphenyl)isoquinolin-1-amine?
The CAS number of 3-(2-Methylphenyl)isoquinolin-1-amine is 23023-38-3.
What is the molecular formula of 3-(2-Methylphenyl)isoquinolin-1-amine?
The molecular formula of 3-(2-Methylphenyl)isoquinolin-1-amine is C16H14N2.
What is the molecular weight of 3-(2-Methylphenyl)isoquinolin-1-amine?
The molecular weight of 3-(2-Methylphenyl)isoquinolin-1-amine is 234.12 g/mol.
Where can I buy 3-(2-Methylphenyl)isoquinolin-1-amine?
You can request a quote for 3-(2-Methylphenyl)isoquinolin-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-(2-Methylphenyl)isoquinolin-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methylphenyl)isoquinolin-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.