Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate
TL;DR: Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate (CAS 1024265-60-8) is a chemical compound with molecular formula C14H20N2O3 and molecular weight 264.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate
Also Known As: Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate, Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,7,8-pentahydrocinnoline-4-carboxylate
Technical Specifications
| Molecular Formula | C14H20N2O3 |
| Molecular Weight | 264.1474 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.1474 Da |
| Heavy Atoms | 19 |
| Complexity | 489.0 |
| SMILES | CCOC(=O)C1C(=NNC2=C1C(=O)CC(C2)(C)C)C |
| InChIKey | UJWCXFIZKIVRIM-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate
Property Insights of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate?
The CAS number of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate is 1024265-60-8.
What is the molecular formula of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate?
The molecular formula of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate is C14H20N2O3.
What is the molecular weight of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate?
The molecular weight of Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate is 264.1474 g/mol.
Where can I buy Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate?
You can request a quote for Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydrocinnoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.