1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione
TL;DR: 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione (CAS 242812-07-3) is a chemical compound with molecular formula C12H11F3N2O2 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-propan-2-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione
Also Known As: Peakdale1_000300, 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione, 4-propan-2-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione, 1-isopropyl-6-(trifluoromethyl)-4H-quinoxaline-2,3-dione
| Molecular Formula | C12H11F3N2O2 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 2.2895 |
| Topological Polar Surface Area | 54.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.07727 |
| Heavy Atoms | 19 |
| Complexity | 741.1936 |
Chemical Identifiers
| CAS Number | 242812-07-3 |
|---|---|
| SMILES | CC(C)N1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C1=O |
Product Overview
1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione (CAS 242812-07-3), with molecular formula C12H11F3N2O2 and molecular weight 272.08 g/mol. IUPAC: 4-propan-2-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione.
Chemical Property Profile of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione
Property Insights of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione
The XLogP value of 2.2895 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione. With a topological polar surface area (TPSA) of 54.86 Ų, 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-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
Frequently Asked Questions
What is the CAS number of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione?
The CAS number of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione is 242812-07-3.
What is the molecular formula of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione?
The molecular formula of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione is C12H11F3N2O2.
What is the molecular weight of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione?
The molecular weight of 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione is 272.08 g/mol.
Where can I buy 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione?
You can request a quote for 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Isopropyl-6-(trifluoromethyl)-1H,4H-quinoxaline-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.