6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline
TL;DR: 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline (CAS 883954-75-4) is a chemical compound with molecular formula C18H18F3NO4S and molecular weight 401.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-2-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline
Also Known As: 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline, 6,7-dimethoxy-2-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline, 6,7-dimethoxy-2-{[2-(trifluoromethyl)phenyl]sulfonyl}-1,2,3,4-tetrahydroisoquinoline
| Molecular Formula | C18H18F3NO4S |
|---|---|
| Molecular Weight | 401.09 g/mol |
| LogP | 3.4696 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.09085 |
| Heavy Atoms | 27 |
| Complexity | 957.56445 |
Chemical Identifiers
| CAS Number | 883954-75-4 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)OC |
Product Overview
6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline (CAS 883954-75-4), with molecular formula C18H18F3NO4S and molecular weight 401.09 g/mol. IUPAC: 6,7-dimethoxy-2-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Property Insights of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 3.4696 indicates that 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline has 0 hydrogen bond donor(s) and 4 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 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline is 883954-75-4.
What is the molecular formula of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline is C18H18F3NO4S.
What is the molecular weight of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline is 401.09 g/mol.
Where can I buy 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dimethoxy-2-((2-(trifluoromethyl)phenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.