Basic information
- Standard SMILES
O=C(Nc1cnccc1[C@@H]1CCC[C@H](N2C(=O)c3ccccc3C2=O)C1)c1ccc(F)c(Br)n1- InChIKey
ATXFGWGRHMNSKO-CABCVRRESA-N- Molecular formula
- C25H20BrFN4O3
- Average molar mass
- 523.4 g/mol
- Monoisotopic mass
- 522.07028
Names & identifiers
- Preferred name
- 6-bromo-N-(4-((1R,3S)-3-(1,3-dioxoisoindolin-2-yl)-cyclohexyl)pyridin-3-yl)-5-fluoropicolinamide
- IUPAC
- 6-bromo-N-[4-[(1R,3S)-3-(1,3-dioxoisoindol-2-yl)cyclohexyl]-3-pyridinyl]-5-fluoropyridine-2-carboxamide
Names & synonyms
SCHEMBL3218929ATXFGWGRHMNSKO-CABCVRRESA-N6-bromo-N-(4-((1R,3S)-3-(1,3-dioxoisoindolin-2-yl)-cyclohexyl)pyridin-3-yl)-5-fluoropicolinamide6-bromo-N-(4-((1R,3S)-3-(1,3-dioxoisoindolin-2-yl)cyclohexyl)pyridin-3-yl)-5-fluoropicolinamide
Database identifiers
- PubChem CID
- 86639733
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 776
Related reactions
4 records
Compound notes
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