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4-phenyl-2-(2-phenylethyl)-1(2H)-phthalazinone

HCID 722795
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=c1c2ccccc2c(-c2ccccc2)nn1CCc1ccccc1
InChIKey
DJLPOIJVTSXGOS-UHFFFAOYSA-N
Molecular formula
C22H18N2O
Average molar mass
326.4 g/mol
Monoisotopic mass
326.1419132

Names & identifiers

Preferred name
4-phenyl-2-(2-phenylethyl)-1(2H)-phthalazinone
IUPAC
4-phenyl-2-(2-phenylethyl)phthalazin-1-one

Names & synonyms

4-phenyl-2-(2-phenylethyl)-1(2H)-phthalazinone4-phenyl-2-(2-phenylethyl)-2-hydrophthalazin-1-oneCBMicro_042659Oprea1_778843SCHEMBL8555258DJLPOIJVTSXGOS-UHFFFAOYSA-NAKOS001632741CCG-106522ST015286BIM-0042625.P001SR-01000432402SR-01000432402-1
Show more names
4-PHENYL-2-(2-PHENYLETHYL)-1,2-DIHYDROPHTHALAZIN-1-ONE

Database identifiers

PubChem CID
722795

Properties

Computed structural propertiesFilling in

XLogP
4.8
Topological polar surface area
32.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
488

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Related reactions

2 records
New reaction record
HRID 54970 reaction equation
HRID 54970As productuspto-grants-1997_04
HRID 1224070 reaction equation
HRID 1224070As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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