1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone
TL;DR: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone (CAS 349435-01-4) is a chemical compound with molecular formula C23H21NOS and molecular weight 359.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone
Also Known As: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone, 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-phenyl-2-(phenylsulfanyl)ethanone, 2-phenyl-2-phenylthio-1-(2-1,2,3,4-tetrahydroisoquinolyl)ethan-1-one
| Molecular Formula | C23H21NOS |
|---|---|
| Molecular Weight | 359.13 g/mol |
| LogP | 5.1049 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.1344 |
| Heavy Atoms | 26 |
| Complexity | 878.97925 |
Chemical Identifiers
| CAS Number | 349435-01-4 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4 |
Product Overview
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone (CAS 349435-01-4), with molecular formula C23H21NOS and molecular weight 359.13 g/mol. IUPAC: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone.
Chemical Property Profile of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone
Property Insights of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone
The XLogP value of 5.1049 indicates that 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone?
The CAS number of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone is 349435-01-4.
What is the molecular formula of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone?
The molecular formula of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone is C23H21NOS.
What is the molecular weight of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone?
The molecular weight of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone is 359.13 g/mol.
Where can I buy 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone?
You can request a quote for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-phenyl-2-phenylsulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.