1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-
TL;DR: 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- (CAS 22330-48-9) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-diethoxy-2-methylbenzo[de]isoquinoline-1,3-dione
Also Known As: 4,5-Ethoxy-1,8-naphthalic acid-N-methylimide, 4,5-Diethoxynaphthalsaeure-N-methylimid, 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-, 6,7-Diethoxy-2-methyl-1H-benz(de)isoquinoline-1,3(2H)-dione, 6,7-Diethoxy-2-methyl-1H-benz[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 22330-48-9 |
|---|---|
| SMILES | CCOC1=C2C(=CC=C3C2=C(C=C1)C(=O)N(C3=O)C)OCC |
| InChIKey | RTCBXWGDLADPJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- (CAS 22330-48-9), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: 6,7-diethoxy-2-methylbenzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-
Property Insights of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-. With a topological polar surface area (TPSA) of 55.8 Ų, 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- 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 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-?
The CAS number of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- is 22330-48-9.
What is the molecular formula of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-?
The molecular formula of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- is C17H17NO4.
What is the molecular weight of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-?
The molecular weight of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- is 299.12 g/mol.
Where can I buy 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-?
You can request a quote for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.