Structure Info
- Chemspace ID
- CSMB20476935169 (Enamine MADE)
- IUPAC Name
- 1-tert-butyl 4-methyl 5-(3-bromo-6-chloropyrazin-2-yl)-1,2,3,6-tetrahydropyridine-1,4-dicarboxylate
- Mol formula
- C16H19BrClN3O4
- Mol weight
- 433 Da
- Catalog Number(s)
- BBV-1326488455
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.81
- Heavy atoms count
- 25
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 82
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20476935169
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