Structure Info
- Chemspace ID
- CSMB18016820129 (Enamine MADE)
- IUPAC Name
- 3-{2-fluoro-6-[(methylamino)methyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy}propanenitrile
- Mol formula
- C17H24BFN2O3
- Mol weight
- 334 Da
- Catalog Number(s)
- BBV-1254310367
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.87
- Heavy atoms count
- 24
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.588
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB18016820129
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