Structure Info
- Chemspace ID
- CSMB00025789372 (Enamine MADE)
- CAS
- 2138176-27-7
- MFCD
- MFCD30735273
- IUPAC Name
- 1-tert-butyl 3-chloromethyl 5-[methyl(propan-2-yl)amino]piperidine-1,3-dicarboxylate
- Mol formula
- C16H29ClN2O4
- Mol weight
- 349 Da
- Catalog Number(s)
- BBV-110012742, CSC025789372, EN300-387238, FCH9172936
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.49
- Heavy atoms count
- 23
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.875
- Polar surface area (Å)
- 59
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00025789372
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