Basic information
- Standard SMILES
O=C1c2c(I)cccc2CN1CCCc1ccc(Oc2ccc(F)cc2)cc1- InChIKey
OKZVTLCATFFCRK-UHFFFAOYSA-N- Molecular formula
- C23H19FINO2
- Average molar mass
- 487.3 g/mol
- Monoisotopic mass
- 487.04445
Names & identifiers
- Preferred name
- 2-{3-[4-(4-Fluoro-phenoxy)-phenyl]-propyl}-7-iodo-2,3-dihydro-isoindol-1-one
- IUPAC
- 2-[3-[4-(4-fluorophenoxy)phenyl]propyl]-7-iodo-3H-isoindol-1-one
Names & synonyms
SCHEMBL1091614OKZVTLCATFFCRK-UHFFFAOYSA-N2-{3-[4-(4-fluoro-phenoxy)-phenyl]-propyl}-7-iodo-2,3-dihydro-isoindol-1-one
Database identifiers
- PubChem CID
- 57455232
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 517
Related reactions
4 records
Compound notes
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