4-[(2,4-Dipropoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Basic information
- CAS
820237-41-0- Standard SMILES
CCCOc1ccc(C=C2C(=O)NN(c3ccccc3)C2=O)c(OCCC)c1- InChIKey
FPYGHGYJAWWIKF-UHFFFAOYSA-N- Molecular formula
- C22H24N2O4
- Average molar mass
- 380.4 g/mol
- Monoisotopic mass
- 380.17360725
Names & identifiers
- Preferred name
- 4-[(2,4-Dipropoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
- IUPAC
- 4-[(2,4-dipropoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Names & synonyms
SCHEMBL5447326DTXSID807405334-[(2,4-Dipropoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Database identifiers
- CAS
820237-41-0- PubChem CID
- 69445261
- DTXSID
DTXSID80740533
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 571
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Compound notes
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