Basic information
- Standard SMILES
CC(C(=O)c1c(O)c2cccnc2n(-c2cccc(OC(F)(F)F)c2)c1=O)c1ccccc1- InChIKey
PBOIHOJXABKUFD-UHFFFAOYSA-N- Molecular formula
- C24H17F3N2O4
- Average molar mass
- 454.4 g/mol
Names & identifiers
- Preferred name
- 4-hydroxy-3-(2-phenylpropionyl)-1-(3-trifluoromethoxyphenyl)-1,8-naphthyridin-2(1H)-one
- IUPAC
- 4-hydroxy-3-(2-phenylpropanoyl)-1-[3-(trifluoromethoxy)phenyl]-1,8-naphthyridin-2-one
Names & synonyms
4-hydroxy-3-(2-phenylpropionyl)-1-(3-trifluoromethoxyphenyl)-1,8-naphthyridin-2(1H)-oneSCHEMBL4190277
Database identifiers
- PubChem CID
- 68948935
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 778
Related reactions
2 records
Compound notes
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