Structure Info
- Chemspace ID
- CSSS18486164843 (In-Stock Screening Compounds)
- IUPAC Name
- 3-{1-[3-({6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}methoxy)-2-hydroxypropyl]-1H-1,2,3-triazol-4-yl}pyridine-4-carbonitrile
- Mol formula
- C21H25N5O2
- Mol weight
- 379 Da
- Catalog Number(s)
- Z9044848913, s_274090____12941748____22847654
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.05
- Heavy atoms count
- 28
- Rotatable bond count
- 7
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.523
- Polar surface area (Å)
- 97
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS18486164843
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