Structure Info
- Chemspace ID
- CSMB02229140549 (Enamine MADE)
- IUPAC Name
- methyl 2-amino-4-bromo-5-(hex-4-en-1-yloxy)benzoate
- Mol formula
- C14H18BrNO3
- Mol weight
- 328 Da
- Catalog Number(s)
- BBV-287570732
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.26
- Heavy atoms count
- 19
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.35714285714286
- Polar surface area (Å)
- 62
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB02229140549
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