Structure Info
- Chemspace ID
- CSMB20270393785 (Enamine MADE)
- IUPAC Name
- 1-tert-butyl 3-(4,5,6,7-tetrachloro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) 4-methyl-4-(trifluoromethyl)pyrrolidine-1,3-dicarboxylate
- Mol formula
- C20H17Cl4F3N2O6
- Mol weight
- 580 Da
- Catalog Number(s)
- EN300-51789870
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.45
- Heavy atoms count
- 35
- Rotatable bond count
- 6
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20270393785
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