Structure Info
- Chemspace ID
- CSMB00161164073 (Enamine MADE)
- IUPAC Name
- 5-({[2-(tert-butoxy)-2-oxoethyl]amino}methyl)-2,4-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
- Mol formula
- C22H34BNO6
- Mol weight
- 419 Da
- Catalog Number(s)
- CSC161164073, EN300-26630538
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.66
- Heavy atoms count
- 30
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.636
- Polar surface area (Å)
- 94
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00161164073
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