Structure Info
- Chemspace ID
- CSMB03578052966 (Enamine MADE)
- IUPAC Name
- ethyl 6-cyano-2-oxo-1,2,3,4-tetrahydroquinoline-8-carboxylate
- Mol formula
- C13H12N2O3
- Mol weight
- 244 Da
- Catalog Number(s)
- BBV-431413456
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.38
- Heavy atoms count
- 18
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.30769230769231
- Polar surface area (Å)
- 79
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03578052966
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