Structure Info
- Chemspace ID
- CSMB20471863853 (Enamine MADE)
- IUPAC Name
- 2-[(tert-butoxy)carbonyl]-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxylic acid
- Mol formula
- C22H32BNO6
- Mol weight
- 417 Da
- Catalog Number(s)
- BBV-1321232840
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.44
- Heavy atoms count
- 30
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.636
- Polar surface area (Å)
- 85
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20471863853
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