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1-Benzyl-3-[(4-benzylmorpholin-2-yl)methyl]benzimidazol-2-one

HCID 70601714
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=c1n(Cc2ccccc2)c2ccccc2n1CC1CN(Cc2ccccc2)CCO1
InChIKey
ZOOCAOXTJTZMIM-UHFFFAOYSA-N
Molecular formula
C26H27N3O2
Average molar mass
413.5 g/mol

Names & identifiers

Preferred name
1-Benzyl-3-[(4-benzylmorpholin-2-yl)methyl]benzimidazol-2-one
IUPAC
1-benzyl-3-[(4-benzylmorpholin-2-yl)methyl]benzimidazol-2-one

Database identifiers

PubChem CID
70601714

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
36 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
31
Formal charge
0
Complexity
587

Related reactions

1 records
New reaction record
HRID 2339040 reaction equation
HRID 2339040As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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