![N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine structure](/static/products/866/866150-38-1.png)
N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine
TL;DR: N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine (CAS 866150-38-1) is a chemical compound with molecular formula C17H11F3N2O and molecular weight 316.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-isoquinolin-5-yl-1-[4-(trifluoromethoxy)phenyl]methanimine
Also Known As: N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine, N-isoquinolin-5-yl-1-[4-(trifluoromethoxy)phenyl]methanimine, (1E)-N-(isoquinolin-5-yl)-1-[4-(trifluoromethoxy)phenyl]methanimine
| Molecular Formula | C17H11F3N2O |
|---|---|
| Molecular Weight | 316.08 g/mol |
| LogP | 4.884 |
| Topological Polar Surface Area | 34.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.08234 |
| Heavy Atoms | 23 |
| Complexity | 837.0814 |
Chemical Identifiers
| CAS Number | 866150-38-1 |
|---|---|
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)N=CC3=CC=C(C=C3)OC(F)(F)F |
Product Overview
N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine (CAS 866150-38-1), with molecular formula C17H11F3N2O and molecular weight 316.08 g/mol. IUPAC: N-isoquinolin-5-yl-1-[4-(trifluoromethoxy)phenyl]methanimine.
Chemical Property Profile of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine
Property Insights of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine
The XLogP value of 4.884 indicates that N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.48 Ų, N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine has 0 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 N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine?
The CAS number of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine is 866150-38-1.
What is the molecular formula of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine?
The molecular formula of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine is C17H11F3N2O.
What is the molecular weight of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine?
The molecular weight of N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine is 316.08 g/mol.
Where can I buy N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine?
You can request a quote for N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine?
Yes, KEHONG BIO provides custom synthesis services for N-{(E)-[4-(trifluoromethoxy)phenyl]methylidene}-5-isoquinolinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.