3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-1H-indol-2-one
Basic information
- CAS
70452-25-4- Standard SMILES
Cc1ccc(C(=O)CC2(O)C(=O)Nc3ccccc32)cc1- InChIKey
RCHROJNZFUYAPD-UHFFFAOYSA-N- Molecular formula
- C17H15NO3
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.10519334
Names & identifiers
- Preferred name
- 3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-1H-indol-2-one
- IUPAC
- 3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-1H-indol-2-one
Names & synonyms
3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-1H-indol-2-one70452-25-4CHEMBL45867933-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-oneNSC297832CBMicro_014968Oprea1_399294Oprea1_733900SCHEMBL28454292DTXSID70315835SMSF0005258BDBM50523821
Show more names
STK117845AKOS000543282AKOS021998649CB14240CCG-110764NSC-297832BIM-0014850.P001EU-0043755
Database identifiers
- CAS
70452-25-4- PubChem CID
- 326413
- DTXSID
DTXSID70315835- ChEMBL
CHEMBL4586793- Nikkaji
- J3.214.905G
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 428
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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