Structure Info
- Chemspace ID
- CSMB00003327751 (Enamine MADE)
- MFCD
- MFCD17523185
- IUPAC Name
- ethyl 2-[(1-benzothiophen-3-yl)(hydroxy)methyl]butanoate
- Mol formula
- C15H18O3S
- Mol weight
- 278 Da
- Catalog Number(s)
- BBV-34680108, CSC003327751
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.35
- Heavy atoms count
- 19
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.4
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00003327751
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