4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione
TL;DR: 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione (CAS 113565-96-1) is a chemical compound with molecular formula C15H15NO2 and molecular weight 241.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-phenyl-1,3,4,6,7,8-hexahydroquinoline-2,5-dione
Also Known As: AI-559/11192012, 4-phenyl-1,3,4,6,7,8-hexahydroquinoline-2,5-dione, 4-phenyl-3,4,7,8-tetrahydroquinoline-2,5(1H,6H)-dione, 4-Phenyl-4,6,7,8-tetrahydro-1H,3H-quinoline-2,5-dione, 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione
Technical Specifications
| Molecular Formula | C15H15NO2 |
| Molecular Weight | 241.11028 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.11028 Da |
| Heavy Atoms | 18 |
| Complexity | 405.0 |
| SMILES | C1CC2=C(C(CC(=O)N2)C3=CC=CC=C3)C(=O)C1 |
| InChIKey | BBYMTXZYFNHJKE-UHFFFAOYSA-N |
Chemical Property Profile of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione
Property Insights of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione. With a topological polar surface area (TPSA) of 46.2 Ų, 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione?
The CAS number of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione is 113565-96-1.
What is the molecular formula of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione?
The molecular formula of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione is C15H15NO2.
What is the molecular weight of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione?
The molecular weight of 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione is 241.11028 g/mol.
Where can I buy 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione?
You can request a quote for 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione?
Yes, CoreyChem provides custom synthesis services for 4-phenyl-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.