2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
TL;DR: 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CAS 409354-92-3) is a chemical compound with molecular formula C17H17NO4S and molecular weight 331.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3,4-dihydro-1H-isoquinoline
Also Known As: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline, AH-487/15274290, 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3,4-dihydro-1H-isoquinoline, 6-(2-1,2,3,4-tetrahydroisoquinolylsulfonyl)-2H,3H-benzo[e]1,4-dioxin
| Molecular Formula | C17H17NO4S |
|---|---|
| Molecular Weight | 331.09 g/mol |
| LogP | 2.2048 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 331.08783 |
| Heavy Atoms | 23 |
| Complexity | 847.42194 |
Chemical Identifiers
| CAS Number | 409354-92-3 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)OCCO4 |
Product Overview
2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CAS 409354-92-3), with molecular formula C17H17NO4S and molecular weight 331.09 g/mol. IUPAC: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Property Insights of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 2.2048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline. With a topological polar surface area (TPSA) of 55.84 Ų, 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline 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 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline is 409354-92-3.
What is the molecular formula of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline is C17H17NO4S.
What is the molecular weight of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline is 331.09 g/mol.
Where can I buy 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.