2-{1-[4-(5-Fluoro-2-methoxy-pyridin-3-yl)-phenyl]-ethyl}-isoindole-1,3-dione
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Basic information
- Standard SMILES
COc1ncc(F)cc1-c1ccc(C(C)N2C(=O)c3ccccc3C2=O)cc1- InChIKey
YEYUMYYAMATEDR-UHFFFAOYSA-N- Molecular formula
- C22H17FN2O3
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.12232057
Names & identifiers
- Preferred name
- 2-{1-[4-(5-Fluoro-2-methoxy-pyridin-3-yl)-phenyl]-ethyl}-isoindole-1,3-dione
- IUPAC
- 2-[1-[4-(5-fluoro-2-methoxy-3-pyridinyl)phenyl]ethyl]isoindole-1,3-dione
Names & synonyms
SCHEMBL2006367YEYUMYYAMATEDR-UHFFFAOYSA-N2-{1-[4-(5-fluoro-2-methoxy-pyridin-3-yl)-phenyl]-ethyl}-isoindole-1,3-dione
Database identifiers
- PubChem CID
- 67245083
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 59.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 568
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Related reactions
2 records
Compound notes
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