Basic information
- CAS
32410-02-9- Standard SMILES
O=C(OC1(c2nccc3ccccc23)C(=O)Nc2ccccc21)c1ccccc1- InChIKey
NLXGUYUPJOFWEE-UHFFFAOYSA-N- Molecular formula
- C24H16N2O3
- Average molar mass
- 380.4 g/mol
- Monoisotopic mass
- 380.11609238
Names & identifiers
- Preferred name
- 3-(Isoquinolin-1-yl)-2-oxo-2,3-dihydro-1h-indol-3-yl benzoate
- IUPAC
- (3-isoquinolin-1-yl-2-oxo-1H-indol-3-yl) benzoate
Names & synonyms
32410-02-93-(isoquinolin-1-yl)-2-oxo-2,3-dihydro-1h-indol-3-yl benzoateNSC133076DTXSID50299826NSC-133076
Database identifiers
- CAS
32410-02-9- PubChem CID
- 280866
- DTXSID
DTXSID50299826
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 632
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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