Basic information
- Standard SMILES
CCOC(=O)c1cc(-c2ccc(C(C/C(=N\O)c3ccnc(C)c3)c3ccc(Cl)cc3F)cc2)cs1- InChIKey
OZVUEOVKXYTKSL-HMZBKAONSA-N- Molecular formula
- C28H24ClFN2O3S
- Average molar mass
- 523 g/mol
Names & identifiers
- Preferred name
- ethyl 4-[4-[(3E)-1-(4-chloro-2-fluorophenyl)-3-hydroxyimino-3-(2-methyl-4-pyridinyl)propyl]phenyl]thiophene-2-carboxylate
- IUPAC
- ethyl 4-[4-[(3E)-1-(4-chloro-2-fluorophenyl)-3-hydroxyimino-3-(2-methyl-4-pyridinyl)propyl]phenyl]thiophene-2-carboxylate
Names & synonyms
SCHEMBL362898
Database identifiers
- PubChem CID
- 136167036
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 750
Related reactions
2 records
Compound notes
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