Structure Info
- Chemspace ID
- CSMB00161161992 (Enamine MADE)
- IUPAC Name
- 3-(4-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperazin-1-yl)-4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
- Mol formula
- C33H37BN2O6
- Mol weight
- 568 Da
- Catalog Number(s)
- CSC161161992, EN300-26629915
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 7.16
- Heavy atoms count
- 42
- Rotatable bond count
- 6
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.393
- Polar surface area (Å)
- 89
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00161161992
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