1-(4-{3-[(1H-1,3-benzodiazol-2-yl)methoxy]-4-fluoropyrrolidin-1-yl}piperidin-1-yl)ethan-1-one
AlkaPlorer ID: AK104461
Synonym: None
IUPAC Name: 1-[4-[(3S,4R)-3-(1H-benzimidazol-2-ylmethoxy)-4-fluoropyrrolidin-1-yl]piperidin-1-yl]ethanone
Structure
SMILES: CC(=O)N1CCC(N2C[C@@H](F)[C@@H](OCC3=NC4=CC=CC=C4N3)C2)CC1
InChI: InChI=1S/C19H25FN4O2/c1-13(25)23-8-6-14(7-9-23)24-10-15(20)18(11-24)26-12-19-21-16-4-2-3-5-17(16)22-19/h2-5,14-15,18H,6-12H2,1H3,(H,21,22)/t15-,18+/m1/s1
InChIKey: DEVKKSKVEUQZOB-QAPCUYQASA-N
Source
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Properties Information
Molecule Weight: 360.43300000000016
TPSA？: 61.46
MolLogP？: 2.1127
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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