Structure Info
- Chemspace ID
- CSMB00040702021 (Enamine MADE)
- IUPAC Name
- 1-(4-amino-3-bromobenzoyl)-3-methylpiperidine-3-carboxylic acid
- Mol formula
- C14H17BrN2O3
- Mol weight
- 341 Da
- Catalog Number(s)
- BBV-38943383, CSC040702021, CSCR01730751977, Z1543201047, s_240690____24717134____13574442
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.72
- Heavy atoms count
- 20
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.428
- Polar surface area (Å)
- 84
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00040702021
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