![8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline structure](/static/products/883/883960-34-7.webp)
8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
TL;DR: 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline (CAS 883960-34-7) is a chemical compound with molecular formula C22H27NO4S and molecular weight 401.16608 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(2,3,5,6-tetramethylphenyl)sulfonyl-2,3,4,7,9,10-hexahydro-[1,4]dioxepino[2,3-g]isoquinoline
Also Known As: 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline, 8-(2,3,5,6-tetramethylphenyl)sulfonyl-2,3,4,7,9,10-hexahydro-[1,4]dioxepino[2,3-g]isoquinoline, 8-[(2,3,5,6-tetramethylphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Technical Specifications
| Molecular Formula | C22H27NO4S |
| Molecular Weight | 401.16608 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 401.16608 Da |
| Heavy Atoms | 28 |
| Complexity | 633.0 |
| SMILES | CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC3=CC4=C(C=C3C2)OCCCO4)C)C |
| InChIKey | AALDULFUBGKMQG-UHFFFAOYSA-N |
Chemical Property Profile of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Property Insights of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
The XLogP value of 4.1 indicates that 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline. Following Lipinski's Rule of Five, 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline 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
What is the CAS number of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline?
The CAS number of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline is 883960-34-7.
What is the molecular formula of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline?
The molecular formula of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline is C22H27NO4S.
What is the molecular weight of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline?
The molecular weight of 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline is 401.16608 g/mol.
Where can I buy 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline?
You can request a quote for 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline?
Yes, CoreyChem provides custom synthesis services for 8-((2,3,5,6-tetramethylphenyl)sulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.