1-(2,6-Difluorobenzyl)-4-methyl-2-(pyridin-4-yl)-1H-benzo[d]imidazole

• Catalog: OFC199594757
• CAS: 199594-75-7
• Category: Fluorinated Benzimidazoles
• Synonyms: 1H-Benzimidazole, 1-((2,6-difluorophenyl)methyl)-4-methyl-2-(4-pyridinyl)-
• Purity: 97%

• IUPAC Name: 1-[(2,6-difluorophenyl)methyl]-4-methyl-2-pyridin-4-ylbenzimidazole
• InChI: InChI=1S/C20H15F2N3/c1-13-4-2-7-18-19(13)24-20(14-8-10-23-11-9-14)25(18)12-15-16(21)5-3-6-17(15)22/h2-11H,12H2,1H3
• InChI Key: KVKNXIWANBJVAP-UHFFFAOYSA-N
• Isomeric SMILES: CC1=C2C(=CC=C1)N(C(=N2)C3=CC=NC=C3)CC4=C(C=CC=C4F)F

• Molecular Formula: C20H15F2N3
• Molecular Weight: 335.36

• XLogP3-AA: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 335.12340382 g/mol
• Monoisotopic Mass: 335.12340382 g/mol
• Topological Polar Surface Area: 30.7Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 433