Structure Info
- Chemspace ID
- CSMB00025788780 (Enamine MADE)
- CAS
- 2137484-72-9
- MFCD
- MFCD30734981
- IUPAC Name
- chloromethyl 2-{[(tert-butoxy)carbonyl]amino}-3-(quinolin-3-yl)propanoate
- Mol formula
- C18H21ClN2O4
- Mol weight
- 365 Da
- Catalog Number(s)
- BBV-118326868, CSC025788780, EN300-386945
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.49
- Heavy atoms count
- 25
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.388
- Polar surface area (Å)
- 78
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00025788780
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