Structure Info
- Chemspace ID
- CSMB20269946727 (Enamine MADE)
- IUPAC Name
- rac-4,5,6,7-tetrachloro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (1R,3S)-3-{[(tert-butoxy)carbonyl]amino}-7-oxaspiro[3.5]nonane-1-carboxylate
- Mol formula
- C22H22Cl4N2O7
- Mol weight
- 568 Da
- Catalog Number(s)
- EN300-51791205
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.39
- Heavy atoms count
- 35
- Rotatable bond count
- 6
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.545
- Polar surface area (Å)
- 111
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20269946727
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