Structure Info
- Chemspace ID
- CSMB00102691855 (Enamine MADE)
- CAS
- 1104605-45-9
- IUPAC Name
- 2-{[(tert-butoxy)carbonyl]amino}-3-(5,6-difluoro-1H-indol-3-yl)propanoic acid
- Mol formula
- C16H18F2N2O4
- Mol weight
- 340 Da
- Catalog Number(s)
- BBV-113838670, CSC102691855, EN300-801905, SY309068
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.95
- Heavy atoms count
- 24
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 91
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSMB00102691855
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