3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione
TL;DR: 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione (CAS 54289-76-8) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-1-methylquinoline-2,4-dione
Also Known As: 3-acetyl-1-methylquinoline-2,4-dione, 3-acetyl-1-methyl-quinoline-2,4-dione, 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione, 3-acetyl-4-hydroxy-1-methyl-1,2-dihydroquinolin-2-one
| Molecular Formula | C12H11NO3 |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 1.0509 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.0739 |
| Heavy Atoms | 16 |
| Complexity | 492.79218 |
Chemical Identifiers
| CAS Number | 54289-76-8 |
|---|---|
| SMILES | CC(=O)C1C(=O)C2=CC=CC=C2N(C1=O)C |
Product Overview
3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione (CAS 54289-76-8), with molecular formula C12H11NO3 and molecular weight 217.07 g/mol. IUPAC: 3-acetyl-1-methylquinoline-2,4-dione.
Chemical Property Profile of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione
Property Insights of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione
The XLogP value of 1.0509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione. With a topological polar surface area (TPSA) of 54.45 Ų, 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione 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
Frequently Asked Questions
What is the CAS number of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione?
The CAS number of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione is 54289-76-8.
What is the molecular formula of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione?
The molecular formula of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione is C12H11NO3.
What is the molecular weight of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione?
The molecular weight of 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione is 217.07 g/mol.
Where can I buy 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione?
You can request a quote for 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-1-methyl-2,4(1H,3H)-quinolinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.