2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide
TL;DR: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide (CAS 904262-24-4) is a chemical compound with molecular formula C25H26N2O3S and molecular weight 434.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide
Also Known As: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide, 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-(2-(phenylthio)phenyl)acetamide, 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
| Molecular Formula | C25H26N2O3S |
|---|---|
| Molecular Weight | 434.17 g/mol |
| LogP | 4.8518 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 434.1664 |
| Heavy Atoms | 31 |
| Complexity | 1055.8877 |
Chemical Identifiers
| CAS Number | 904262-24-4 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)OC |
Product Overview
2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide (CAS 904262-24-4), with molecular formula C25H26N2O3S and molecular weight 434.17 g/mol. IUPAC: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide.
Chemical Property Profile of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide
Property Insights of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide
The XLogP value of 4.8518 indicates that 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide 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 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide?
The CAS number of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide is 904262-24-4.
What is the molecular formula of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide?
The molecular formula of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide is C25H26N2O3S.
What is the molecular weight of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide?
The molecular weight of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide is 434.17 g/mol.
Where can I buy 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide?
You can request a quote for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.