![2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione structure](/static/products/848/848989-59-3.png)
2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione
TL;DR: 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione (CAS 848989-59-3) is a chemical compound with molecular formula C28H28N2O5 and molecular weight 472.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione
Also Known As: 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione, 2-(3,4-dimethoxyphenethyl)-6-(piperidine-1-carbonyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, 2-[2-(3,4-Dimethoxy-phenyl)-ethyl]-6-(piperidine-1-carbonyl)-benzo[de]isoquinoline-1,3-dione, 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidin-1-ylcarbonyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C28H28N2O5 |
|---|---|
| Molecular Weight | 472.20 g/mol |
| LogP | 4.3218 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.19983 |
| Heavy Atoms | 35 |
| Complexity | 1304.1674 |
Chemical Identifiers
| CAS Number | 848989-59-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)C3=C4C(=C(C=C3)C(=O)N5CCCCC5)C=CC=C4C2=O)OC |
Product Overview
2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione (CAS 848989-59-3), with molecular formula C28H28N2O5 and molecular weight 472.20 g/mol. IUPAC: 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione
Property Insights of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione
The XLogP value of 4.3218 indicates that 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione 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 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione?
The CAS number of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione is 848989-59-3.
What is the molecular formula of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione?
The molecular formula of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione is C28H28N2O5.
What is the molecular weight of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione?
The molecular weight of 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione is 472.20 g/mol.
Where can I buy 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione?
You can request a quote for 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)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-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(piperidine-1-carbonyl)benzo[de]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.