3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione
TL;DR: 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione (CAS 7204-42-4) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-heptyl-3-hydroxy-1H-quinoline-2,4-dione
Also Known As: MY-12-62a, MY 12-62a, MY12-62a, 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione, 3-heptyl-3-hydroxy-1H-quinoline-2,4-dione
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 7204-42-4 |
|---|---|
| SMILES | CCCCCCCC1(C(=O)C2=CC=CC=C2NC1=O)O |
| InChIKey | FVEWTXHYDMOBCF-UHFFFAOYSA-N |
Product Overview
3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione (CAS 7204-42-4), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 3-heptyl-3-hydroxy-1H-quinoline-2,4-dione.
Chemical Property Profile of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione
Property Insights of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione
The XLogP value of 3.5 indicates that 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione. Following Lipinski's Rule of Five, 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione has 2 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-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione?
The CAS number of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione is 7204-42-4.
What is the molecular formula of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione?
The molecular formula of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione is C16H21NO3.
What is the molecular weight of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione?
The molecular weight of 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione is 275.15 g/mol.
Where can I buy 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione?
You can request a quote for 3-Heptyl-3-hydroxy-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-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-Heptyl-3-hydroxy-2,4(1H,3H)-quinolinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.