5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione
TL;DR: 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione (CAS 153504-79-1) is a chemical compound with molecular formula C9H4BrF3N2O2 and molecular weight 307.94083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione
Also Known As: 5-bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione, Maybridge3_000465, IDI1_011852, 5-Bromo-7-trifluoromethyl-1,4-dihydro-2,3-quinoxalinedione, BRD-K10008681-001-01-0
Technical Specifications
| Molecular Formula | C9H4BrF3N2O2 |
| Molecular Weight | 307.94083 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 307.94083 Da |
| Heavy Atoms | 17 |
| Complexity | 361.0 |
| SMILES | C1=C(C=C(C2=C1NC(=O)C(=O)N2)Br)C(F)(F)F |
| InChIKey | XRZJFNLLFBTUGL-UHFFFAOYSA-N |
Chemical Property Profile of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione
Property Insights of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione?
The CAS number of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione is 153504-79-1.
What is the molecular formula of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione?
The molecular formula of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione is C9H4BrF3N2O2.
What is the molecular weight of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione?
The molecular weight of 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione is 307.94083 g/mol.
Where can I buy 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione?
You can request a quote for 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione?
Yes, CoreyChem provides custom synthesis services for 5-Bromo-7-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.