Structure Info
- Chemspace ID
- CSSS01109193109 (In-Stock Screening Compounds)
- IUPAC Name
- (2R,3S)-4-[(5-chloro-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-methylmorpholine-3-carboxylic acid
- Mol formula
- C15H18ClNO4
- Mol weight
- 312 Da
- Catalog Number(s)
- CSCR01109193109, Z3351686537
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.14
- Heavy atoms count
- 21
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.53333333333333
- Polar surface area (Å)
- 59
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS01109193109
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