Structure Info
- Chemspace ID
- CSMB03592881889 (Enamine MADE)
- IUPAC Name
- 1-[(3-chlorophenyl)methyl]-2-oxo-6-(propan-2-yl)-1,2-dihydropyridine-3-carbonitrile
- Mol formula
- C16H15ClN2O
- Mol weight
- 287 Da
- Catalog Number(s)
- BBV-401821454
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.47
- Heavy atoms count
- 20
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 44
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB03592881889
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