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2'-Phthalimidomethylbiphenyl-2-carboxylic acid benzylamide

HCID 67318032
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(NCc1ccccc1)c1ccccc1-c1ccccc1CN1C(=O)c2ccccc2C1=O
InChIKey
HCGVSMGUWYHMMF-UHFFFAOYSA-N
Molecular formula
C29H22N2O3
Average molar mass
446.5 g/mol

Names & identifiers

Preferred name
2'-Phthalimidomethylbiphenyl-2-carboxylic acid benzylamide
IUPAC
N-benzyl-2-[2-[(1,3-dioxoisoindol-2-yl)methyl]phenyl]benzamide

Names & synonyms

SCHEMBL2210449HCGVSMGUWYHMMF-UHFFFAOYSA-N2'-phthalimidomethylbiphenyl-2-carboxylic acid benzylamide

Database identifiers

PubChem CID
67318032

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
66.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
34
Formal charge
0
Complexity
722

Related reactions

5 records
New reaction record
HRID 213241 reaction equation
HRID 213241As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1014078 reaction equation
HRID 1014078As productuspto-grants-2011_07
HRID 1860605 reaction equation
HRID 1860605As productuspto-grants-2003_03
HRID 2109534 reaction equation
HRID 2109534As productuspto-grants-2009_04
HRID 2119743 reaction equation
HRID 2119743As productuspto-grants-2004_02

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes