Structure Info
- Chemspace ID
- CSMB00699288364 (Enamine MADE)
- CAS
- 2636932-06-2
- IUPAC Name
- 1-[4-(2-hydroxypropyl)-3-methylpiperazin-1-yl]but-2-yn-1-one
- Mol formula
- C12H20N2O2
- Mol weight
- 224 Da
- Catalog Number(s)
- BBV-361733680, CSCR00699288364, EN300-39289142, Z1873544712
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.65
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.75
- Polar surface area (Å)
- 44
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00699288364
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