Structure Info
- Chemspace ID
- CSMB00025789364 (Enamine MADE)
- CAS
- 2137426-47-0
- MFCD
- MFCD30735265
- IUPAC Name
- tert-butyl (3S)-4-{5-[(chloromethoxy)carbonyl]piperidin-3-yl}-3-methylpiperazine-1-carboxylate
- Mol formula
- C17H30ClN3O4
- Mol weight
- 376 Da
- Catalog Number(s)
- BBV-118326710, CSC025789364, EN300-387230
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.59
- Heavy atoms count
- 25
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.882
- Polar surface area (Å)
- 71
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00025789364
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