4-(4-((2,4-Dioxothiazolidin-5-ylidene)methyl)-2-methoxyphenoxy)-3-(trifluoromethyl)benzonitrile

• Catalog: OFC1055361357
• CAS: 1055361-35-7
• Category: Fluorinated Nitriles
• Purity: 95%
• MDL Number: MFCD29034874

• Molecular Formula: C19H11F3N2O4S
• Molecular Weight: 420.36
• Molar Refractivity: 101.85

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 3.7
• MLogP: 1.78
• SILICOS-IT: 4.44
• WLogP: 5.36
• XLogP3: 4.3
• iLogP: 2.61
• BBB Permeant: No
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: Yes
• CYP2C9 Inhibitor: Yes
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: Yes
• GI Absorption: Low
• LogKp: -5.81 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.11