1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone
TL;DR: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone (CAS 877968-85-9) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1H-indol-3-yl)ethanone
Also Known As: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone, 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1H-indol-3-yl)ethanone, 1-[6,7-DIMETHOXY-3,4-DIHYDRO-2(1H)-ISOQUINOLINYL]-2-(1H-INDOL-3-YL)-1-ETHANONE
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 3.3125 |
| Topological Polar Surface Area | 54.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 961.0446 |
Chemical Identifiers
| CAS Number | 877968-85-9 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CNC4=CC=CC=C43)OC |
Product Overview
1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone (CAS 877968-85-9), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1H-indol-3-yl)ethanone.
Chemical Property Profile of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone
Property Insights of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone
The XLogP value of 3.3125 indicates that 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.56 Ų, 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone has 1 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 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone?
The CAS number of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone is 877968-85-9.
What is the molecular formula of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone?
The molecular formula of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone is C21H22N2O3.
What is the molecular weight of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone?
The molecular weight of 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone is 350.16 g/mol.
Where can I buy 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone?
You can request a quote for 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(1H-indol-3-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.