2-Oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile

• Catalog: OFC116548040-1
• CAS: 116548-04-0
• Category: Fluorinated Nitriles
• Purity: 95%
• MDL Number: MFCD09749653

• Molecular Formula: C7H3F3N2O
• Molecular Weight: 188.11
• Molar Refractivity: 36.78

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 1.0
• Veber: 0.0
• Consensus LogP: 1.54
• MLogP: 0.74
• SILICOS-IT: 2.5
• WLogP: 2.42
• XLogP3: 1.03
• iLogP: 1.03
• BBB Permeant: Yes
• CYP1A2 Inhibitor: No
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -6.72 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.14

• GHS Pictogram: GHS07
• Hazard Statements: H302
• Precautionary Statements: P280-P305+P351+P338