Structure Info
- Chemspace ID
- CSMB03567554535 (Enamine MADE)
- IUPAC Name
- 1-[5-hydroxy-4-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropane-1-carbonitrile
- Mol formula
- C17H22BNO4
- Mol weight
- 315 Da
- Catalog Number(s)
- BBV-413329404
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.56
- Heavy atoms count
- 23
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.588
- Polar surface area (Å)
- 72
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03567554535
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