TL;DR: Flumioxazin (CAS 103361-09-7) is a chemical compound with molecular formula C19H15FN2O4 and molecular weight 354.1016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione
Also Known As: Flumioxazin, Sumisoya, Flumioxazine, Flumioxazin [ISO], Flumizin
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H15FN2O4 |
| Molecular Weight | 354.1016 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 66.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.1016 Da |
| Heavy Atoms | 26 |
| Complexity | 724.0 |
| Melting Point | 201-204 °C |
| Density | 1.5136 g/ml @ 20 °C |
| Vapor Pressure | 2.41X10-6 mm Hg @ 25 °C |
| Solubility | Soluble in common organic solvents |
| SMILES | C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F |
| InChIKey | FOUWCSDKDDHKQP-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Flumioxazin. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Flumioxazin. Following Lipinski's Rule of Five, Flumioxazin has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Flumioxazin is 103361-09-7.
The molecular formula of Flumioxazin is C19H15FN2O4.
The molecular weight of Flumioxazin is 354.1016 g/mol.
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