N-[4-[(4Z)-4-[(4-Dimethylaminophenyl)hydrazinylidene]-3-methyl-5-oxo-pyrazol-1-YL]phenyl]-2-methyl-prop-2-enamide
Basic information
- CAS
84618-98-4- Standard SMILES
C=C(C)C(=O)Nc1ccc(-n2[nH]c(C)c(N=Nc3ccc(N(C)C)cc3)c2=O)cc1- InChIKey
BYFAFDIJQJPWIW-UHFFFAOYSA-N- Molecular formula
- C22H24N6O2
- Average molar mass
- 404.5 g/mol
- Monoisotopic mass
- 404.19607403
Names & identifiers
- Preferred name
- N-[4-[(4Z)-4-[(4-Dimethylaminophenyl)hydrazinylidene]-3-methyl-5-oxo-pyrazol-1-YL]phenyl]-2-methyl-prop-2-enamide
- IUPAC
- N-[4-[4-[[4-(dimethylamino)phenyl]diazenyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]phenyl]-2-methylprop-2-enamide
Names & synonyms
84618-98-4NSC343506N-[4-[(4Z)-4-[(4-DIMETHYLAMINOPHENYL)HYDRAZINYLIDENE]-3-METHYL-5-OXO-PYRAZOL-1-YL]PHENYL]-2-METHYL-PROP-2-ENAMIDEDTXSID80425636NSC-343506DS-002301N-[4-((4E)-4-{[4-(Dimethylamino)phenyl]hydrazono}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)phenyl]-2-methylacrylamideN-[4-(4-{2-[4-(Dimethylamino)phenyl]hydrazinylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)phenyl]-2-methylprop-2-enamideN-[4-[(4E)-4-[(4-dimethylaminophenyl)hydrazono]-3-methyl-5-oxo-pyrazol-1-yl]phenyl]-2-methyl-prop-2-enamide
Database identifiers
- CAS
84618-98-4- PubChem CID
- 335134
- DTXSID
DTXSID80425636
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 728
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Compound notes
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