4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine
TL;DR: 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine (CAS 859664-04-3) is a chemical compound with molecular formula C19H19F3N2O3 and molecular weight 380.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-6-methyl-N-[3-(trifluoromethyl)phenyl]-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-amine
Also Known As: 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine, 4-methoxy-6-methyl-N-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-amine, 4-methoxy-6-methyl-N-[3-(trifluoromethyl)phenyl]-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-amine
| Molecular Formula | C19H19F3N2O3 |
|---|---|
| Molecular Weight | 380.13 g/mol |
| LogP | 4.0413 |
| Topological Polar Surface Area | 42.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.13477 |
| Heavy Atoms | 27 |
| Complexity | 870.00885 |
Chemical Identifiers
| CAS Number | 859664-04-3 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C(=C2C1NC4=CC=CC(=C4)C(F)(F)F)OC)OCO3 |
Product Overview
4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine (CAS 859664-04-3), with molecular formula C19H19F3N2O3 and molecular weight 380.13 g/mol. IUPAC: 4-methoxy-6-methyl-N-[3-(trifluoromethyl)phenyl]-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-amine.
Chemical Property Profile of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine
Property Insights of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine
The XLogP value of 4.0413 indicates that 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.96 Ų, 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine has 1 hydrogen bond donor(s) and 5 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-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine?
The CAS number of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine is 859664-04-3.
What is the molecular formula of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine?
The molecular formula of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine is C19H19F3N2O3.
What is the molecular weight of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine?
The molecular weight of 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine is 380.13 g/mol.
Where can I buy 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine?
You can request a quote for 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-6-methyl-N-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.