Structure Info
- Chemspace ID
- CSMB03451699770 (Enamine MADE)
- IUPAC Name
- 2-[(1-bromocyclopropyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
- Mol formula
- C13H16BrNO2
- Mol weight
- 298 Da
- Catalog Number(s)
- BBV-363978719, Z4954296020, s_2230_20804948_10901804, s_2230____20804948____10901804
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.59
- Heavy atoms count
- 17
- Rotatable bond count
- 2
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.538
- Polar surface area (Å)
- 44
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB03451699770
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