Structure Info
- Chemspace ID
- CSMB20271180115 (Enamine MADE)
- IUPAC Name
- 7-tert-butyl 9-(4,5,6,7-tetrachloro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) 2-oxa-7-azaspiro[4.4]nonane-7,9-dicarboxylate
- Mol formula
- C21H20Cl4N2O7
- Mol weight
- 554 Da
- Catalog Number(s)
- EN300-51793611
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.98
- Heavy atoms count
- 34
- Rotatable bond count
- 5
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.523
- Polar surface area (Å)
- 102
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20271180115
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