Structure Info
- Chemspace ID
- CSMB00116221151 (Enamine MADE)
- CAS
- 2248291-37-2
- IUPAC Name
- 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 7-{[(tert-butoxy)carbonyl]amino}-8,8-dimethyl-2-oxabicyclo[4.2.0]octane-7-carboxylate
- Mol formula
- C23H28N2O7
- Mol weight
- 444 Da
- Catalog Number(s)
- BBV-159629722, CSC116221151, EN300-6522267, FCH20149596
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.07
- Heavy atoms count
- 32
- Rotatable bond count
- 6
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.565
- Polar surface area (Å)
- 111
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00116221151
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