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1-(2,4-Dimethoxyphenyl)-3-ferrocenyl-2-propen-1-one
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NAMES
  • 1-(2,4-Dimethoxyphenyl)-3-ferrocenyl-2-propen-1-one
SMILES
COc1ccc(C(=O)/C=C/C23C4C5C6C2[Fe]56432789C3C2C7C8C39)c(OC)c1
InChI
InChI=1S/C16H15O3.C5H5.Fe/c1-18-13-8-9-14(16(11-13)19-2)15(17)10-7-12-5-3-4-6-12;1-2-4-5-3-1;/h3-11H,1-2H3;1-5H;/b10-7+;;
MOLECULAR FORMULA
C21H20FeO3
CROSS REFERENCES
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1-(2,4-Dimethoxyphenyl)-3-ferrocenyl-2-propen-1-one

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 376.08
AlogP 5.20
HBond donors 0
HBond acceptors 3
Atoms 45
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 1-(2,4-Dimethoxyphenyl)-3-ferrocenyl-2-propen-1-one.