Basic information
- Standard SMILES
CCOc1ccc(NC=C(C#N)C(=O)Nc2cc(OC)c(Cl)cc2Cl)cc1F- InChIKey
BRPZCPFCHZOQPF-UHFFFAOYSA-N- Molecular formula
- C19H16Cl2FN3O3
- Average molar mass
- 424.2 g/mol
Names & identifiers
- Preferred name
- 4-ethoxy-3-fluoroanilino-N-(2,4-dichloro-5-methoxyphenyl)-2-cyano-2-propenamide
- IUPAC
- 2-cyano-N-(2,4-dichloro-5-methoxyphenyl)-3-(4-ethoxy-3-fluoroanilino)prop-2-enamide
Names & synonyms
SCHEMBL5103178BRPZCPFCHZOQPF-UHFFFAOYSA-N4-ethoxy-3-fluoroanilino-N-(2,4-dichloro-5-methoxyphenyl)-2-cyano-2-propenamide
Database identifiers
- PubChem CID
- 69312263
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 83.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 612
Related reactions
3 records
Compound notes
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