Structure Info
- Chemspace ID
- CSMB00010411633 (Enamine MADE)
- MFCD
- MFCD24468294
- IUPAC Name
- 1-tert-butyl 4-ethyl 5-hydroxy-1,2,3,6-tetrahydropyridine-1,4-dicarboxylate
- Mol formula
- C13H21NO5
- Mol weight
- 271 Da
- Catalog Number(s)
- A029197346, A141172, AA01FOU9, AG01FOX1, AG304249, AR01FPM1, AY11549, BB4LS-BD632636, BBV-45041102, BD632636, C73904, CS-0161822, CSC010411633, GIA11140, HY-W108230, LN04729689, R646717, X213592, Y1225105
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.23
- Heavy atoms count
- 19
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.692
- Polar surface area (Å)
- 76
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00010411633
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