6-chloro-4-(prop-2-yn-1-yloxy)-1H-pyrazolo[3,4-d]pyrimidine
Structure Info
- Chemspace ID
- CSMB00013070310 (Enamine MADE)
- MFCD
- MFCD24263264, MFCD24263264
- IUPAC Name
- 6-chloro-4-(prop-2-yn-1-yloxy)-1H-pyrazolo[3,4-d]pyrimidine
- Mol formula
- C8H5ClN4O
- Mol weight
- 209 Da
- Catalog Number(s)
- BBV-46421804, CSC013070310, IMED1525543162
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.31
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00013070310
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