Basic information
- Standard SMILES
CC1(C)OC(=O)[C@@H](CC(=O)N2CCN(c3ccc(F)cc3)CC2)O1- InChIKey
MWZWJHCKATUATP-CQSZACIVSA-N- Molecular formula
- C17H21FN2O4
- Average molar mass
- 336.36 g/mol
- Monoisotopic mass
- 336.14853532
Names & identifiers
- Preferred name
- (5R)-5-{2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl}-2,2-dimethyl-1,3-dioxolan-4-one
- IUPAC
- (5R)-5-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-2,2-dimethyl-1,3-dioxolan-4-one
Names & synonyms
SCHEMBL1006571MWZWJHCKATUATP-CQSZACIVSA-N(5R)-5-{2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl}-2,2-dimethyl-1,3-dioxolan-4-one(5R)-5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-2,2-dimethyl-1,3-dioxolan-4-one
Database identifiers
- PubChem CID
- 11709792
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 483
Related reactions
4 records
Compound notes
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