![ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate structure](/static/products/383/383377-76-2.png)
ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate
TL;DR: ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate (CAS 383377-76-2) is a chemical compound with molecular formula C22H23NO4 and molecular weight 365.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3-dimethyl-1,13-dioxo-2,4,6,7-tetrahydroisoquinolino[2,1-a]quinoline-12-carboxylate
Also Known As: ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate, ethyl 3,3-dimethyl-1,13-dioxo-2,4,6,7-tetrahydroisoquinolino[2,1-a]quinoline-12-carboxylate
| Molecular Formula | C22H23NO4 |
|---|---|
| Molecular Weight | 365.16 g/mol |
| LogP | 3.4032 |
| Topological Polar Surface Area | 65.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.16272 |
| Heavy Atoms | 27 |
| Complexity | 1029.3387 |
Chemical Identifiers
| CAS Number | 383377-76-2 |
|---|---|
| SMILES | CCOC(=O)C1=C2C3=CC=CC=C3CCN2C4=C(C1=O)C(=O)CC(C4)(C)C |
Product Overview
ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate (CAS 383377-76-2), with molecular formula C22H23NO4 and molecular weight 365.16 g/mol. IUPAC: ethyl 3,3-dimethyl-1,13-dioxo-2,4,6,7-tetrahydroisoquinolino[2,1-a]quinoline-12-carboxylate.
Chemical Property Profile of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate
Property Insights of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate
The XLogP value of 3.4032 indicates that ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.37 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate. Following Lipinski's Rule of Five, ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate 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 ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate?
The CAS number of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate is 383377-76-2.
What is the molecular formula of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate?
The molecular formula of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate is C22H23NO4.
What is the molecular weight of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate?
The molecular weight of ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate is 365.16 g/mol.
Where can I buy ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate?
You can request a quote for ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3-dimethyl-1,13-dioxo-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinoline-12-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.