Basic information
- Standard SMILES
O=C1c2c(I)cc(Cl)cc2CN1C1CCN(C2CCC(F)(F)CC2)CC1- InChIKey
HHDLIYODPXMGQL-UHFFFAOYSA-N- Molecular formula
- C19H22ClF2IN2O
- Average molar mass
- 494.7 g/mol
Names & identifiers
- Preferred name
- 2-[1-(4,4-Difluorocyclohexyl)piperidin-4-yl]-5-chloro-7-iodo-2,3-dihydro-1H-isoindol-1-one
- IUPAC
- 5-chloro-2-[1-(4,4-difluorocyclohexyl)piperidin-4-yl]-7-iodo-3H-isoindol-1-one
Names & synonyms
2-[1-(4,4-Difluorocyclohexyl)piperidin-4-yl]-5-chloro-7-iodo-2,3-dihydro-1H-isoindol-1-oneSCHEMBL1867790
Database identifiers
- PubChem CID
- 67193003
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 534
Related reactions
2 records
Compound notes
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