![2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione structure](/static/products/452/452089-19-9.png)
2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione
TL;DR: 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione (CAS 452089-19-9) is a chemical compound with molecular formula C27H28N2O6S and molecular weight 508.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione
Also Known As: 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione, 2-(3,4-dimethoxy-5-(piperidin-1-ylsulfonyl)phenethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, 2-{2-[3,4-dimethoxy-5-(piperidin-1-ylsulfonyl)phenyl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C27H28N2O6S |
|---|---|
| Molecular Weight | 508.17 g/mol |
| LogP | 3.8703 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 508.1668 |
| Heavy Atoms | 36 |
| Complexity | 1409.8605 |
Chemical Identifiers
| CAS Number | 452089-19-9 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)S(=O)(=O)N5CCCCC5)OC |
Product Overview
2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione (CAS 452089-19-9), with molecular formula C27H28N2O6S and molecular weight 508.17 g/mol. IUPAC: 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione
Property Insights of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione
The XLogP value of 3.8703 indicates that 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione?
The CAS number of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione is 452089-19-9.
What is the molecular formula of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione?
The molecular formula of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione is C27H28N2O6S.
What is the molecular weight of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione?
The molecular weight of 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione is 508.17 g/mol.
Where can I buy 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione?
You can request a quote for 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(3,4-dimethoxy-5-piperidin-1-ylsulfonylphenyl)ethyl]benzo[de]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.