Basic information
- Standard SMILES
CCC1(N2C(=O)c3c(F)c(F)c(F)c(F)c3C2=O)C(=O)NC(=O)N(C2CCCCC2)C1=O- InChIKey
OEWYNRRJPZVYKF-UHFFFAOYSA-N- Molecular formula
- C20H17F4N3O5
- Average molar mass
- 455.4 g/mol
Names & identifiers
- Preferred name
- 1-Cyclohexyl-5-ethyl-5-(4,5,6,7-tetrafluoro-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione
- IUPAC
- 1-cyclohexyl-5-ethyl-5-(4,5,6,7-tetrafluoro-1,3-dioxoisoindol-2-yl)-1,3-diazinane-2,4,6-trione
Names & synonyms
SCHEMBL825842OEWYNRRJPZVYKF-UHFFFAOYSA-N1-Cyclohexyl-5-ethyl-5-(4,5,6,7-tetrafluoro-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- PubChem CID
- 24765669
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 849
Related reactions
2 records
Compound notes
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