Structure Info
- Chemspace ID
- CSMB20476681669 (Enamine MADE)
- IUPAC Name
- 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 3,3-dimethylhex-5-ynoate
- Mol formula
- C16H15NO4
- Mol weight
- 285 Da
- Catalog Number(s)
- BBV-1326227712
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.65
- Heavy atoms count
- 21
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.3125
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20476681669
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