4-(Methylthio)-2-(trifluoromethyl)benzaldehyde

• Catalog: OFC1289164551
• CAS: 1289164-55-1
• Category: Fluorinated Aldehydes
• Purity: 97%
• MDL Number: MFCD24141367

• Molecular Formula: C9H7F3OS
• Molecular Weight: 220.21
• Molar Refractivity: 48.55

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 3.17
• MLogP: 3.08
• SILICOS-IT: 3.58
• WLogP: 4.39
• XLogP3: 2.78
• iLogP: 2.02
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -5.67 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.22