Structure Info
- Chemspace ID
- CSSS20621755346 (In-Stock Screening Compounds)
- IUPAC Name
- N-{1-[2-(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetyl]-3-methylpiperidin-4-yl}-4-hydroxy-1-benzofuran-3-carboxamide
- Mol formula
- C26H27ClN2O6
- Mol weight
- 499 Da
- Catalog Number(s)
- Z9362925716
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.65
- Heavy atoms count
- 35
- Rotatable bond count
- 4
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.384
- Polar surface area (Å)
- 101
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSS20621755346
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