Structure Info
- Chemspace ID
- CSMB00161158709 (Enamine MADE)
- IUPAC Name
- 3-({[2-(tert-butoxy)-2-oxoethyl]amino}methyl)-2,4,6-trimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
- Mol formula
- C23H36BNO6
- Mol weight
- 433 Da
- Catalog Number(s)
- CSC161158709, EN300-26631728
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.97
- Heavy atoms count
- 31
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.652
- Polar surface area (Å)
- 94
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00161158709
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