Structure Info
- Chemspace ID
- CSMB20471776239 (Enamine MADE)
- IUPAC Name
- 4-{[(2-{[(tert-butoxy)carbonyl]amino}ethyl)carbamoyl]methyl}-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
- Mol formula
- C22H33BN2O7
- Mol weight
- 448 Da
- Catalog Number(s)
- BBV-1321142335
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.92
- Heavy atoms count
- 32
- Rotatable bond count
- 9
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.59
- Polar surface area (Å)
- 123
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSMB20471776239
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