1-{4-[4-(2-Chloro-benzyl)-piperazin-1-ylmethyl]-benzyl}-3-[3-(4-fluoro-phenoxy)-propyl]-1,3-dihydro-benzoimidazol-2-ylideneamine

HCID 46240677
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Basic information

Standard SMILES
N=c1n(CCCOc2ccc(F)cc2)c2ccccc2n1Cc1ccc(CN2CCN(Cc3ccccc3Cl)CC2)cc1
InChIKey
PJLMFBGJKFNYLG-UHFFFAOYSA-N
Molecular formula
C35H37ClFN5O
Average molar mass
598.1 g/mol
Monoisotopic mass
597.2670667

Names & identifiers

Preferred name
1-{4-[4-(2-Chloro-benzyl)-piperazin-1-ylmethyl]-benzyl}-3-[3-(4-fluoro-phenoxy)-propyl]-1,3-dihydro-benzoimidazol-2-ylideneamine
IUPAC
1-[[4-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]phenyl]methyl]-3-[3-(4-fluorophenoxy)propyl]benzimidazol-2-imine

Names & synonyms

SCHEMBL2495677PJLMFBGJKFNYLG-UHFFFAOYSA-N1-{4-[4-(2-chloro-benzyl)-piperazin-1-ylmethyl]-benzyl}-3-[3-(4-fluoro-phenoxy)-propyl]-1,3-dihydro-benzoimidazol-2-ylideneamine

Database identifiers

PubChem CID
46240677

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
46 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
11
Heavy atoms
43

Related reactions

1 records
New reaction record

Linked notes

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