2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione
TL;DR: 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione (CAS 19125-99-6) is a chemical compound with molecular formula C20H24N2O2 and molecular weight 324.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butyl-6-(butylamino)benzo[de]isoquinoline-1,3-dione
Also Known As: Solvent Yellow 43, Fluorol 7GA, Fluorol-7GA, C.I.Solvent Yellow 43, Diethylethylidenemalonate
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.18378 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 324.18378 Da |
| Heavy Atoms | 24 |
| Complexity | 465.0 |
| Solubility | 2.1 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | CCCCNC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCCC |
| InChIKey | DXWHZJXKTHGHQF-UHFFFAOYSA-N |
Chemical Property Profile of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione
Property Insights of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione
The XLogP value of 4.6 indicates that 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione 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
What is the CAS number of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione?
The CAS number of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione is 19125-99-6.
What is the molecular formula of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione?
The molecular formula of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione is C20H24N2O2.
What is the molecular weight of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione?
The molecular weight of 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione is 324.18378 g/mol.
Where can I buy 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione?
You can request a quote for 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione?
Yes, CoreyChem provides custom synthesis services for 2-butyl-6-(butylamino)-1H-benzo(de)isoquinoline-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.