Structure Info
- Chemspace ID
- CSMB20620674737 (Enamine MADE)
- CAS
- 2248302-80-7
- IUPAC Name
- rac-3-tert-butyl 1-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) (1R,5S)-5-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane-1,3-dicarboxylate
- Mol formula
- C20H19F3N2O6
- Mol weight
- 440 Da
- Catalog Number(s)
- EN300-6526094
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.69
- Heavy atoms count
- 31
- Rotatable bond count
- 6
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20620674737
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