Structure Info
- Chemspace ID
- CSMB03496569386 (Enamine MADE)
- CAS
- 2680848-76-2
- IUPAC Name
- methyl 4-bromo-5-{[(tert-butoxy)carbonyl]amino}-6-methylpyridine-2-carboxylate
- Mol formula
- C13H17BrN2O4
- Mol weight
- 345 Da
- Catalog Number(s)
- BBV-391734443, EN300-28297744
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.76
- Heavy atoms count
- 20
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 78
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03496569386
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