Structure Info
- Chemspace ID
- CSMB00699314495 (Enamine MADE)
- IUPAC Name
- but-2-yn-1-yl 5-bromo-3-methylpyridine-2-carboxylate
- Mol formula
- C11H10BrNO2
- Mol weight
- 268 Da
- Catalog Number(s)
- BBV-1208924321, CSCR00699314495, Z3156230683, s_1458_13756770_6198796, s_1458____13756770____6198796
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.29
- Heavy atoms count
- 15
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.272
- Polar surface area (Å)
- 39
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00699314495
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