Basic information
- Standard SMILES
Cc1ccc(NCC(=O)c2ccc(F)cc2)cc1Nc1ncc(-c2ccc(C#N)cc2)o1- InChIKey
QOVDTNFNPKJXHC-UHFFFAOYSA-N- Molecular formula
- C25H19FN4O2
- Average molar mass
- 426.4 g/mol
- Monoisotopic mass
- 426.14920402
Names & identifiers
- Preferred name
- 4-(2-{5-[2-(4-Fluoro-phenyl)-2-oxo-ethylamino]-2-methyl-phenyl amino}-oxazol-5-yl)-benzonitrile
- IUPAC
- 4-[2-[5-[[2-(4-fluorophenyl)-2-oxoethyl]amino]-2-methylanilino]-1,3-oxazol-5-yl]benzonitrile
Names & synonyms
SCHEMBL2338367QOVDTNFNPKJXHC-UHFFFAOYSA-N4-(2-{5-[2-(4-Fluoro-phenyl)-2-oxo-ethylamino]-2-methyl-phenyl amino}-oxazol-5-yl)-benzonitrile
Database identifiers
- PubChem CID
- 11965600
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 91 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 666
Related reactions
1 records
Compound notes
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