4-(but-2-yn-1-yloxy)-6-chloro-1H-pyrazolo[3,4-d]pyrimidine
Structure Info
- Chemspace ID
- CSMB00158876081 (Enamine MADE)
- IUPAC Name
- 4-(but-2-yn-1-yloxy)-6-chloro-1H-pyrazolo[3,4-d]pyrimidine
- Mol formula
- C9H7ClN4O
- Mol weight
- 223 Da
- Catalog Number(s)
- BBV-189334812, CSC158876081
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.15
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.22222222222222
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00158876081
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