3-(3-Fluoro-4-pyridinyl)-3-[3-(2-fluoro-3-pyridinyl)phenyl]isoindol-1-amine
Basic information
- Standard SMILES
NC1=NC(c2cccc(-c3cccnc3F)c2)(c2ccncc2F)c2ccccc21- InChIKey
HOUJQAJPWSQDKH-UHFFFAOYSA-N- Molecular formula
- C24H16F2N4
- Average molar mass
- 398.4 g/mol
Names & identifiers
- Preferred name
- 3-(3-Fluoro-4-pyridinyl)-3-[3-(2-fluoro-3-pyridinyl)phenyl]isoindol-1-amine
- IUPAC
- 3-(3-fluoro-4-pyridinyl)-3-[3-(2-fluoro-3-pyridinyl)phenyl]isoindol-1-amine
Names & synonyms
SCHEMBL2086980
Database identifiers
- PubChem CID
- 59596306
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 643
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Related reactions
1 records
Compound notes
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