Structure Info
- Chemspace ID
- CSMB02495339636 (Enamine MADE)
- CAS
- 2460739-96-0
- MFCD
- MFCD32703220
- IUPAC Name
- tert-butyl (1S,4S)-5-{2-hydroxy-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl}-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
- Mol formula
- C18H22N4O4
- Mol weight
- 358 Da
- Catalog Number(s)
- EN300-6740109
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.21
- Heavy atoms count
- 26
- Rotatable bond count
- 3
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 86
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB02495339636
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