Tert-butyl 4-{[1-(difluoromethyl)-2-oxabicyclo[2.2.2]octan-4-yl]methyl}-3-oxoazepane-1-carboxylate
Structure Info
- Chemspace ID
- CSMB20447496754 (Enamine MADE)
- IUPAC Name
- tert-butyl 4-{[1-(difluoromethyl)-2-oxabicyclo[2.2.2]octan-4-yl]methyl}-3-oxoazepane-1-carboxylate
- Mol formula
- C20H31F2NO4
- Mol weight
- 387 Da
- Catalog Number(s)
- BBV-1295164598
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.34
- Heavy atoms count
- 27
- Rotatable bond count
- 5
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.9
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20447496754
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