Organofluorine / Alfa Chemistry
1-(3-Fluorobenzyl)-2-(piperidin-3-ylmethoxy)-1H-benzo[d]imidazole hydrochloride

1-(3-Fluorobenzyl)-2-(piperidin-3-ylmethoxy)-1H-benzo[d]imidazole hydrochloride

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1-(3-Fluorobenzyl)-2-(piperidin-3-ylmethoxy)-1H-benzo[d]imidazole hydrochloride
Catalog OFC1417794503-2
CAS 1417794-50-3
Category Fluorinated Benzimidazoles
Synonyms 1-[(3-fluorophenyl)methyl]-2-(piperidin-3-ylmethoxy)benzimidazole;hydrochloride
Purity 95%
MDL Number MFCD22631651
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 1-[(3-fluorophenyl)methyl]-2-(piperidin-3-ylmethoxy)benzimidazole;hydrochloride
InChI InChI=1S/C20H22FN3O.ClH/c21-17-7-3-5-15(11-17)13-24-19-9-2-1-8-18(19)23-20(24)25-14-16-6-4-10-22-12-16;/h1-3,5,7-9,11,16,22H,4,6,10,12-14H2;1H
InChI Key KACMKOAVCVBQTO-UHFFFAOYSA-N
Isomeric SMILES C1CC(CNC1)COC2=NC3=CC=CC=C3N2CC4=CC(=CC=C4)F.Cl
Molecular Formula C20H23ClFN3O
Molecular Weight 375.87
Storage Inert atmosphere, room temperature
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 375.1513682 g/mol
Monoisotopic Mass 375.1513682 g/mol
Topological Polar Surface Area 39.1Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 424

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