Structure Info
- Chemspace ID
- CSMB03496568606 (Enamine MADE)
- CAS
- 298693-81-9
- IUPAC Name
- methyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-(4-cyanophenyl)propanoate
- Mol formula
- C19H18N2O4
- Mol weight
- 338 Da
- Catalog Number(s)
- BBV-391735578, EN300-28296750
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.24
- Heavy atoms count
- 25
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.21
- Polar surface area (Å)
- 88
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03496568606
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