Structure Info
- Chemspace ID
- CSMB00025789051 (Enamine MADE)
- CAS
- 2137093-90-2
- MFCD
- MFCD30734551
- IUPAC Name
- chloromethyl (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(quinazolin-4-yl)propanoate
- Mol formula
- C17H20ClN3O4
- Mol weight
- 366 Da
- Catalog Number(s)
- BBV-118326376, CSC025789051, EN300-386508
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.81
- Heavy atoms count
- 25
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.411
- Polar surface area (Å)
- 90
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00025789051
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