3,4-dihydro-1H-quinoline-2,5,8-trione
TL;DR: 3,4-dihydro-1H-quinoline-2,5,8-trione (CAS 15593-52-9) is a chemical compound with molecular formula C9H7NO3 and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-1H-quinoline-2,5,8-trione
Also Known As: 3,4-dihydro-1H-quinoline-2,5,8-trione, 3,4-dihydroquinoline-2,5,8(1h)-trione, 2,5,8(1H)-Quinolinetrione,3,4-dihydro-
| Molecular Formula | C9H7NO3 |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.04259 |
| Heavy Atoms | 13 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 15593-52-9 |
|---|---|
| SMILES | C1CC(=O)NC2=C1C(=O)C=CC2=O |
| InChIKey | KBQJDQNCORENFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-dihydro-1H-quinoline-2,5,8-trione (CAS 15593-52-9), with molecular formula C9H7NO3 and molecular weight 177.04 g/mol. IUPAC: 3,4-dihydro-1H-quinoline-2,5,8-trione.
Chemical Property Profile of 3,4-dihydro-1H-quinoline-2,5,8-trione
Property Insights of 3,4-dihydro-1H-quinoline-2,5,8-trione
The XLogP value of -0.6 indicates that 3,4-dihydro-1H-quinoline-2,5,8-trione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dihydro-1H-quinoline-2,5,8-trione. Following Lipinski's Rule of Five, 3,4-dihydro-1H-quinoline-2,5,8-trione has 1 hydrogen bond donor(s) and 3 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 3,4-dihydro-1H-quinoline-2,5,8-trione?
The CAS number of 3,4-dihydro-1H-quinoline-2,5,8-trione is 15593-52-9.
What is the molecular formula of 3,4-dihydro-1H-quinoline-2,5,8-trione?
The molecular formula of 3,4-dihydro-1H-quinoline-2,5,8-trione is C9H7NO3.
What is the molecular weight of 3,4-dihydro-1H-quinoline-2,5,8-trione?
The molecular weight of 3,4-dihydro-1H-quinoline-2,5,8-trione is 177.04 g/mol.
Where can I buy 3,4-dihydro-1H-quinoline-2,5,8-trione?
You can request a quote for 3,4-dihydro-1H-quinoline-2,5,8-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dihydro-1H-quinoline-2,5,8-trione?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dihydro-1H-quinoline-2,5,8-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.