Structure Info
- Chemspace ID
- CSMB00006004313 (Enamine MADE)
- MFCD
- MFCD16470494
- IUPAC Name
- 4,5-dimethoxy-2-[(propan-2-yl)amino]benzoic acid
- Mol formula
- C12H17NO4
- Mol weight
- 239 Da
- Catalog Number(s)
- BBV-42357520, BC4713305, CSC006004313
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.49
- Heavy atoms count
- 17
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.416
- Polar surface area (Å)
- 68
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00006004313
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