Structure Info
- Chemspace ID
- CSMB03567614458 (Enamine MADE)
- IUPAC Name
- 3,7-dimethyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one
- Mol formula
- C17H24BNO4
- Mol weight
- 317 Da
- Catalog Number(s)
- BBV-413452931
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.89
- Heavy atoms count
- 23
- Rotatable bond count
- 1
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.588
- Polar surface area (Å)
- 57
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03567614458
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