N-(2-fluorophenyl)-2-[(4Z)-4-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetamide

Formula:C22H20N4O3F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(2-fluorophenyl)-2-[(4Z)-4-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetamide is a drug-like molecule.

MolNameN-(2-fluorophenyl)-2-[(4Z)-4-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetamide
MolecularFormulaC22H20N4O3F2
SmilesO=C(CN(C(/C(/N1)=C/c(cc2)cc(F)c2N2CCCC2)=O)C1=O)Nc(cccc1)c1F
InChIInChI=1S/C22H20F2N4O3/c23-15-5-1-2-6-17(15)25-20(29)13-28-21(30)18(26-22(28)31)12-14-7-8-19(16(24)11-14)27-9-3-4-10-27/h1-2,5-8,11-12H,3-4,9-10,13H2,(H,25,29)(H,26,31)
InChIKUIWJDWFTSJYVKF-UHFFFAOYSA-N
TotalMolweight426.422
Molweight426.422
MonoisotopicMass426.150347
CLogP2.6062
CLogS-4.998
H Acceptors7
H Donors2
TotalSurfaceArea309
Relative PSA0.22375
PolarSurfaceArea81.75
Druglikeness4.0523
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! 5-methylene-imidazolidine-2,4-dione
Shape Index0.58065
Fragments1
Non HAtoms31
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Symmetricatoms2
Amides3
Amines1
Aromatic Amines1
StereoCon

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