Basic information
- Standard SMILES
CCCCN1C(=O)C(O)(CC(=O)c2ccccn2)c2ccccc21- InChIKey
YRINCQQVWGPJRQ-UHFFFAOYSA-N- Molecular formula
- C19H20N2O3
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- 1-Butyl-3-hydroxy-3-(2-oxo-2-pyridin-2-ylethyl)indol-2-one
- IUPAC
- 1-butyl-3-hydroxy-3-(2-oxo-2-pyridin-2-ylethyl)indol-2-one
Names & synonyms
1-butyl-3-hydroxy-3-[2-oxo-2-(pyridin-2-yl)ethyl]-1,3-dihydro-2H-indol-2-oneCBKinase1_002947CBKinase1_015347MLS000675342CHEMBL1321532SCHEMBL12335728YRINCQQVWGPJRQ-UHFFFAOYSA-N1-butyl-3-hydroxy-3-(2-oxo-2-pyridin-2-ylethyl)indol-2-oneHMS2605H17STK394733AKOS000357553AKOS022066517
Show more names
SMR000292865ST50893779BRD-A85000100-001-01-21-butyl-3-hydroxy-3-(2-oxo-2-(2-pyridyl)ethyl)indolin-2-one1-butyl-3-hydroxy-3-(2-oxo-2-(pyridin-2-yl)ethyl)indolin-2-one1-butyl-3-hydroxy-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one689767-21-3
Database identifiers
- PubChem CID
- 2944160
- ChEMBL
CHEMBL1321532
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 481
Related reactions
17 records
Compound notes
Loading…