Structure Info
- Chemspace ID
- CSMB03496564182 (Enamine MADE)
- CAS
- 2680702-07-0
- IUPAC Name
- 3,3,3-trifluoro-2-(1H-pyrrol-2-yl)-2-(2,2,2-trifluoroacetamido)propanoic acid
- Mol formula
- C9H6F6N2O3
- Mol weight
- 304 Da
- Catalog Number(s)
- BBV-391740771, EN300-28291057
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.77
- Heavy atoms count
- 20
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 82
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSMB03496564182
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