8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline
TL;DR: 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline (CAS 94209-39-9) is a chemical compound with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)quinoline
Also Known As: IFLab1_003639, BAS 03353007, 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline, 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)quinoline, IDI1_009746
| Molecular Formula | C18H16N2O2S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.09326 |
| Heavy Atoms | 23 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 94209-39-9 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC4=C3N=CC=C4 |
| InChIKey | NNSRXUFSPWCLKK-UHFFFAOYSA-N |
Product Overview
8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline (CAS 94209-39-9), with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol. IUPAC: 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)quinoline.
Chemical Property Profile of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline
Property Insights of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline. With a topological polar surface area (TPSA) of 58.7 Ų, 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline 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 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline?
The CAS number of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline is 94209-39-9.
What is the molecular formula of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline?
The molecular formula of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline is C18H16N2O2S.
What is the molecular weight of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline?
The molecular weight of 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline is 324.09 g/mol.
Where can I buy 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline?
You can request a quote for 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.