Structure Info
- Chemspace ID
- CSSS20521985976 (In-Stock Screening Compounds)
- IUPAC Name
- 5-[(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)methoxy]-2H-chromen-2-one
- Mol formula
- C15H13BrN2O3
- Mol weight
- 349 Da
- Catalog Number(s)
- Z8925963205
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.83
- Heavy atoms count
- 21
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.2
- Polar surface area (Å)
- 53
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS20521985976
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