ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate
TL;DR: ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate (CAS 154819-92-8) is a chemical compound with molecular formula C19H23NO3 and molecular weight 313.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-benzyl-2-oxo-4,5,6,7-tetrahydro-3H-quinoline-4a-carboxylate
Also Known As: ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate, ethyl 1-benzyl-2-oxo-4,5,6,7-tetrahydro-3H-quinoline-4a-carboxylate, 1M-939, ethyl 1-benzyl-2-oxo-1,2,3,4,4a,5,6,7-octahydroquinoline-4a-carboxylate, ethyl1-benzyl-2-oxo-1,2,3,4,4a,5,6,7-octahydroquinoline-4a-carboxylate
Technical Specifications
| Molecular Formula | C19H23NO3 |
| Molecular Weight | 313.1678 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.1678 Da |
| Heavy Atoms | 23 |
| Complexity | 493.0 |
| SMILES | CCOC(=O)C12CCCC=C1N(C(=O)CC2)CC3=CC=CC=C3 |
| InChIKey | MBDOTLCQAGORQF-UHFFFAOYSA-N |
Chemical Property Profile of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate
Property Insights of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate. With a topological polar surface area (TPSA) of 46.6 Ų, ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate has 0 hydrogen bond donor(s) and 3 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 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate?
The CAS number of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate is 154819-92-8.
What is the molecular formula of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate?
The molecular formula of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate is C19H23NO3.
What is the molecular weight of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate?
The molecular weight of ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate is 313.1678 g/mol.
Where can I buy ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate?
You can request a quote for ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate?
Yes, CoreyChem provides custom synthesis services for ethyl 1-benzyl-2-oxo-1,3,4,5,6,7-hexahydro-4a(2H)-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.