3-[4-Fluoro-3-(5-fluoro-3-pyridinyl)phenyl]-3-(3-fluoro-4-pyridinyl)isoindol-1-amine
Basic information
- Standard SMILES
NC1=NC(c2ccc(F)c(-c3cncc(F)c3)c2)(c2ccncc2F)c2ccccc21- InChIKey
RALCSJUFNUFIGU-UHFFFAOYSA-N- Molecular formula
- C24H15F3N4
- Average molar mass
- 416.4 g/mol
- Monoisotopic mass
- 416.12488098
Names & identifiers
- Preferred name
- 3-[4-Fluoro-3-(5-fluoro-3-pyridinyl)phenyl]-3-(3-fluoro-4-pyridinyl)isoindol-1-amine
- IUPAC
- 3-[4-fluoro-3-(5-fluoro-3-pyridinyl)phenyl]-3-(3-fluoro-4-pyridinyl)isoindol-1-amine
Names & synonyms
SCHEMBL2086587
Database identifiers
- PubChem CID
- 59596276
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 675
Related reactions
1 records
Compound notes
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