Methyl 5-bromo-2-fluoro-3-nitrobenzoate

• Catalog: OFC1154278177
• CAS: 1154278-17-7
• Category: Fluorinated Esters
• Purity: 95%
• MDL Number: MFCD12172992

• Molecular Formula: C8H5BrFNO4
• Molecular Weight: 278.03
• Molar Refractivity: 54.2

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 1.9
• MLogP: 2.0
• SILICOS-IT: 0.71
• WLogP: 2.7
• XLogP3: 2.4
• iLogP: 1.69
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: Yes
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -6.29 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.12