Structure Info
- Chemspace ID
- CSCS00044335323 (Synthesis)
- IUPAC Name
- rac-tert-butyl (3aR,8aR)-decahydropyrrolo[3,2-b]azepine-4-carboxylate
- Mol formula
- C13H24N2O2
- Mol weight
- 240 Da
- Catalog Number(s)
- BBV-103600313, CSC044335323, FCH7420542
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.58
- Heavy atoms count
- 17
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.923
- Polar surface area (Å)
- 42
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00044335323
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