6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one
TL;DR: 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one (CAS 71521-93-2) is a chemical compound with molecular formula C18H19NO5S and molecular weight 361.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-4-one
Also Known As: 6,7-DIMETHOXY-2-TOSYL-2,3-DIHYDROISOQUINOLIN-4(1H)-ONE, 6,7-dimethoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-4-one, AE-508/36400041, 2-Tosyl-6,7-dimethoxy-1,2-dihydroisoquinoline-4(3H)-one, 6,7-Dimethoxy-2-(4-methylbenzene-1-sulfonyl)-2,3-dihydroisoquinolin-4(1H)-one
| Molecular Formula | C18H19NO5S |
|---|---|
| Molecular Weight | 361.10 g/mol |
| LogP | 2.39942 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.0984 |
| Heavy Atoms | 25 |
| Complexity | 919.2278 |
Chemical Identifiers
| CAS Number | 71521-93-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC(=C(C=C3C(=O)C2)OC)OC |
Product Overview
6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one (CAS 71521-93-2), with molecular formula C18H19NO5S and molecular weight 361.10 g/mol. IUPAC: 6,7-dimethoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-4-one.
Chemical Property Profile of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one
Property Insights of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one
The XLogP value of 2.39942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one. Following Lipinski's Rule of Five, 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one has 0 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 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one?
The CAS number of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one is 71521-93-2.
What is the molecular formula of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one?
The molecular formula of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one is C18H19NO5S.
What is the molecular weight of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one?
The molecular weight of 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one is 361.10 g/mol.
Where can I buy 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one?
You can request a quote for 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one 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-tosyl-2,3-dihydroisoquinolin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethoxy-2-tosyl-2,3-dihydroisoquinolin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.