Structure Info
- Chemspace ID
- CSMB03451694620 (Enamine MADE)
- IUPAC Name
- 2-(3-bromo-2-methylpropyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
- Mol formula
- C13H18BrNO2
- Mol weight
- 300 Da
- Catalog Number(s)
- BBV-363973350
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.74
- Heavy atoms count
- 17
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.538
- Polar surface area (Å)
- 44
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB03451694620
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