Structure Info
- Chemspace ID
- CSCS06203212251 (Synthesis)
- IUPAC Name
- 8-({[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]methyl}carbamoyl)cubane-1-carboxylic acid
- Mol formula
- C22H26N4O3
- Mol weight
- 394 Da
- Catalog Number(s)
- PV-006663513714, Z8522658550, s_188690____13232872____16795000
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -2.43
- Heavy atoms count
- 29
- Rotatable bond count
- 6
- Number of rings
- 7
- Carbon bond saturation, Fsp3
- 0.68181818181818
- Polar surface area (Å)
- 86
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSCS06203212251
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