2,4-dihydroxy-5-[1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-indol-3-yl]benzonitrile
Basic information
- Standard SMILES
COc1ccc(CN2C(=O)C(c3cc(C#N)c(O)cc3O)c3ccccc32)cc1- InChIKey
RARMXMUMRXHEDA-UHFFFAOYSA-N- Molecular formula
- C23H18N2O4
- Average molar mass
- 386.4 g/mol
Names & identifiers
- Preferred name
- 2,4-dihydroxy-5-[1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-indol-3-yl]benzonitrile
- IUPAC
- 2,4-dihydroxy-5-[1-[(4-methoxyphenyl)methyl]-2-oxo-3H-indol-3-yl]benzonitrile
Names & synonyms
SCHEMBL2305269RARMXMUMRXHEDA-UHFFFAOYSA-N2,4-dihydroxy-5-[1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-indol-3-yl]benzonitrile
Database identifiers
- PubChem CID
- 67356901
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 93.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 638
Related reactions
5 records
Compound notes
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