Tert-butyl ((1-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)piperidin-4-yl)methyl)carbamate

• Catalog: OFC1420888807
• CAS: 1420888-80-7
• Category: Fluorinated Benzimidazoles
• Synonyms: tert-butyl N-[[1-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]methyl]carbamate
• MDL Number: MFCD24379041

• IUPAC Name: tert-butyl N-[[1-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]methyl]carbamate
• InChI: InChI=1S/C25H31FN4O2/c1-25(2,3)32-24(31)27-16-18-12-14-29(15-13-18)23-28-21-6-4-5-7-22(21)30(23)17-19-8-10-20(26)11-9-19/h4-11,18H,12-17H2,1-3H3,(H,27,31)
• InChI Key: QLWWDLQRGPXGQX-UHFFFAOYSA-N
• Isomeric SMILES: CC(C)(C)OC(=O)NCC1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F

• Molecular Formula: C25H31FN4O2
• Molecular Weight: 438.54

• XLogP3-AA: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 438.24310441 g/mol
• Monoisotopic Mass: 438.24310441 g/mol
• Topological Polar Surface Area: 59.4Ų
• Heavy Atom Count: 32
• Formal Charge: 0
• Complexity: 612