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3-[5-(benzyloxy)-2-hydroxyphenyl]-1-(diphenylmethyl)-3-hydroxy-1,3-dihydro-2H-indol-2-one

HCID 67356571
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1N(C(c2ccccc2)c2ccccc2)c2ccccc2C1(O)c1cc(OCc2ccccc2)ccc1O
InChIKey
SPIITMHBECIRJS-UHFFFAOYSA-N
Molecular formula
C34H27NO4
Average molar mass
513.6 g/mol

Names & identifiers

Preferred name
3-[5-(benzyloxy)-2-hydroxyphenyl]-1-(diphenylmethyl)-3-hydroxy-1,3-dihydro-2H-indol-2-one
IUPAC
1-benzhydryl-3-hydroxy-3-(2-hydroxy-5-phenylmethoxyphenyl)indol-2-one

Names & synonyms

SCHEMBL2304313SPIITMHBECIRJS-UHFFFAOYSA-N3-[5-(benzyloxy)-2-hydroxyphenyl]-1-(diphenylmethyl)-3-hydroxy-1,3-dihydro-2H-indol-2-one

Database identifiers

PubChem CID
67356571

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
70 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
39
Formal charge
0
Complexity
783

Related reactions

8 records
New reaction record
HRID 198778 reaction equation
HRID 198778As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 200513 reaction equation
HRID 200513As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1407549 reaction equation
HRID 1407549As productuspto-grants-2014_12
HRID 1407550 reaction equation
HRID 1407550As reactantuspto-grants-2014_12
HRID 1965397 reaction equation
HRID 1965397As productuspto-grants-2013_04
HRID 1965398 reaction equation
HRID 1965398As reactantuspto-grants-2013_04
HRID 2385129 reaction equation
HRID 2385129As productuspto-grants-2012_09
HRID 2385130 reaction equation
HRID 2385130As reactantuspto-grants-2012_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes