Structure Info
- Chemspace ID
- CSMB02518808866 (Enamine MADE)
- CAS
- 2580251-31-4
- IUPAC Name
- 3-{[(benzyloxy)carbonyl]amino}-6-fluoro-2-(trifluoromethyl)benzoic acid
- Mol formula
- C16H11F4NO4
- Mol weight
- 357 Da
- Catalog Number(s)
- BBV-339846708, EN300-27732811
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.23
- Heavy atoms count
- 25
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 76
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB02518808866
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