Basic information
- Standard SMILES
O=C1CCCC(=O)N1c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F- InChIKey
YBPFTOWPXQAXLI-UHFFFAOYSA-N- Molecular formula
- C20H16FN3O3
- Average molar mass
- 365.4 g/mol
Names & identifiers
- Preferred name
- 1-(2-Fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)phenyl)piperidine-2,6-dione
- IUPAC
- 1-[2-fluoro-5-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]piperidine-2,6-dione
Names & synonyms
CHEMBL370217SCHEMBL3388183YBPFTOWPXQAXLI-UHFFFAOYSA-NBDBM501654881-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)phenyl)piperidine-2,6-dione1-[2-Fluoro-5-(4-oxo-3,4-dihydro-phthalazin-1-ylmethyl)-phenyl]-piperidine-2,6-dione1-[2-Fluoro-5-(4-oxo-3,4-dihydrophthalazin-1-ylmethyl)phenyl]piperidine-2,6-dione
Database identifiers
- PubChem CID
- 11675005
- ChEMBL
CHEMBL370217
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 649
Related reactions
2 records
Compound notes
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