3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione
TL;DR: 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione (CAS 144603-51-0) is a chemical compound with molecular formula C17H13Cl2NO2 and molecular weight 333.03235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione
Also Known As: 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione, 3-benzyl-3-dichloromethyl-1h-quinoline-2,4-dione
Technical Specifications
| Molecular Formula | C17H13Cl2NO2 |
| Molecular Weight | 333.03235 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.03235 Da |
| Heavy Atoms | 22 |
| Complexity | 448.0 |
| SMILES | C1=CC=C(C=C1)CC2(C(=O)C3=CC=CC=C3NC2=O)C(Cl)Cl |
| InChIKey | YNMDBFZXPHPVRB-UHFFFAOYSA-N |
Chemical Property Profile of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione
Property Insights of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione
The XLogP value of 3.9 indicates that 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione 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 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione?
The CAS number of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione is 144603-51-0.
What is the molecular formula of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione?
The molecular formula of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione is C17H13Cl2NO2.
What is the molecular weight of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione?
The molecular weight of 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione is 333.03235 g/mol.
Where can I buy 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione?
You can request a quote for 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 3-benzyl-3-(dichloromethyl)-1H-quinoline-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.