Structure Info
- Chemspace ID
- CSMB00035354108 (Enamine MADE)
- CAS
- 1457629-53-6
- IUPAC Name
- 4,5-dimethoxy-2-{[(prop-2-en-1-yloxy)carbonyl]amino}benzoic acid
- Mol formula
- C13H15NO6
- Mol weight
- 281 Da
- Catalog Number(s)
- BBV-38808582, CSC035354108, EN300-28286123
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.9
- Heavy atoms count
- 20
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.23
- Polar surface area (Å)
- 94
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00035354108
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