(1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline
TL;DR: (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline (CAS 902009-66-9) is a chemical compound with molecular formula C20H21NO6S and molecular weight 403.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline
Also Known As: (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline, (1Z)-1-[(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)methylidene]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, (Z)-1-(((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)sulfonyl)methylene)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
| Molecular Formula | C20H21NO6S |
|---|---|
| Molecular Weight | 403.11 g/mol |
| LogP | 2.393 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.10895 |
| Heavy Atoms | 28 |
| Complexity | 1044.9017 |
Chemical Identifiers
| CAS Number | 902009-66-9 |
|---|---|
| SMILES | COC1=C(C=C\2C(=C1)CCN/C2=C\S(=O)(=O)C3=CC4=C(C=C3)OCCO4)OC |
Product Overview
(1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline (CAS 902009-66-9), with molecular formula C20H21NO6S and molecular weight 403.11 g/mol. IUPAC: (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline.
Chemical Property Profile of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline
Property Insights of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline
The XLogP value of 2.393 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline. Following Lipinski's Rule of Five, (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline has 1 hydrogen bond donor(s) and 7 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 (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline?
The CAS number of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline is 902009-66-9.
What is the molecular formula of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline?
The molecular formula of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline is C20H21NO6S.
What is the molecular weight of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline?
The molecular weight of (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline is 403.11 g/mol.
Where can I buy (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline?
You can request a quote for (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for (1Z)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylidene)-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.