Basic information
- CAS
83393-52-6- Standard SMILES
Cc1ccc2c(c1)C(O)(CC(=O)c1ccccn1)C(=O)N2- InChIKey
LZBDRKHGFDMVSB-UHFFFAOYSA-N- Molecular formula
- C16H14N2O3
- Average molar mass
- 282.29 g/mol
- Monoisotopic mass
- 282.10044231
Names & identifiers
- Preferred name
- 3-hydroxy-5-methyl-3-[2-oxo-2-(pyridin-2-yl)ethyl]-1,3-dihydro-2H-indol-2-one
- IUPAC
- 3-hydroxy-5-methyl-3-(2-oxo-2-pyridin-2-ylethyl)-1H-indol-2-one
- English name
- 3-hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one
- Molecular formula
- C16H14N2O3
- Molecular weight
- 282.29
Names & synonyms
83393-52-63-hydroxy-5-methyl-3-[2-oxo-2-(pyridin-2-yl)ethyl]-1,3-dihydro-2H-indol-2-oneAN-655/15450007NSC3650973-hydroxy-5-methyl-3-(2-oxo-2-pyridin-2-ylethyl)-1H-indol-2-oneOprea1_112298DTXSID30320829STK215175AKOS000353569AKOS022061096NSC-365097NCGC00303902-01
Show more names
2H-Indol-2-one, 1,3-dihydro-3-hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-
ST058756DS-004883AB00148670-03SR-01000503242SR-01000503242-13-hydroxy-5-methyl-3-(2-oxo-2-(2-pyridyl)ethyl)indolin-2-one3-hydroxy-5-methyl-3-(2-oxo-2-pyridin-2-yl-ethyl)-1H-indol-2-one3-hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one
Database identifiers
- CAS
83393-52-6- PubChem CID
- 339265
- DTXSID
DTXSID30320829
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 439
Physicochemical properties
- Melting point
- 188 · 188-189 °C(Solv: ethanol (64-17-5))
- Boiling point
- 535.5 · 535.5±50.0 °C(Predicted)
- Density
- 1.325 · 1.325±0.06 g/cm3(Predicted)
- pka
- 11.41 · 11.41±0.20(Predicted)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…