2-[(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide

Formula:C18H10N2O3ClF3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide is a drug-like molecule.

MolName2-[(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide
MolecularFormulaC18H10N2O3ClF3S
SmilesO=C(CN(C(/C(/S1)=C/c(c(F)ccc2)c2Cl)=O)C1=O)Nc(ccc(F)c1)c1F
InChIInChI=1S/C18H10ClF3N2O3S/c19-11-2-1-3-12(21)10(11)7-15-17(26)24(18(27)28-15)8-16(25)23-14-5-4-9(20)6-13(14)22/h1-7H,8H2,(H,23,25)
InChIKCQDSHBQCQXWMGR-UHFFFAOYSA-N
TotalMolweight426.801
Molweight426.801
MonoisotopicMass426.005274
CLogP3.4431
CLogS-5.739
H Acceptors5
H Donors1
TotalSurfaceArea284.96
Relative PSA0.25133
PolarSurfaceArea91.78
Druglikeness3.8733
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.57143
Fragments1
Non HAtoms28
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Amides2
StereoCon

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