N-Benzoylisatin
Basic information
- CAS
28284-05-1- Standard SMILES
O=C1C(=O)N(C(=O)c2ccccc2)c2ccccc21- InChIKey
YKLHWMNKDGZBAX-UHFFFAOYSA-N- Molecular formula
- C15H9NO3
- Average molar mass
- 251.24 g/mol
- Monoisotopic mass
- 251.05824315
Names & identifiers
- Preferred name
- N-Benzoylisatin
- IUPAC
- 1-benzoylindole-2,3-dione
- English name
- 1-Benzoyl-1H-indole-2,3-dione
- Molecular weight
- 0
Names & synonyms
N-Benzoylisatin1-Benzoyl-1H-indole-2,3-dione1-Benzoylisatin28284-05-11-Benzoyl-indole-2,3-dione1H-Indole-2,3-dione, 1-benzoyl-NSC 127078BRN 0016540INDOLE-2,3-DIONE, 1-BENZOYL-NSC-127078DTXSID601825334-21-00-05000 (Beilstein Handbook Reference)
Show more names
UNII-276X936194276X936194RefChem:162910DTXCID001050241H-Indole-2,3-dione, 1-benzoyl-(9CI)1-Benzoylindoline-2,3-dione1-benzoylindole-2,3-dioneCHEMBL118830
Database identifiers
- CAS
28284-05-1- PubChem CID
- 34200
- DTXSID
DTXSID60182533- ChEMBL
CHEMBL118830- UNII
- 276X936194
- Nikkaji
- J62.669D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 412
Physicochemical properties
- FDA UNII
- 276 X936194 · 276X936194
Related reactions
2 records
Compound notes
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