(5Z)-5-[[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Formula:C16H9NO3ClFS Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName(5Z)-5-[[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormulaC16H9NO3ClFS
SmilesO=C(/C(/S1)=C/c(cccc2)c2Oc(cc2)cc(F)c2Cl)NC1=O
InChIInChI=1S/C16H9ClFNO3S/c17-11-6-5-10(8-12(11)18)22-13-4-2-1-3-9(13)7-14-15(20)19-16(21)23-14/h1-8H,(H,19,20,21)
InChIKHECIPPVIVJEVMK-UHFFFAOYSA-N
TotalMolweight349.768
Molweight349.768
MonoisotopicMass348.997569
CLogP3.5918
CLogS-6.496
H Acceptors4
H Donors1
TotalSurfaceArea240.45
Relative PSA0.27045
PolarSurfaceArea80.7
Druglikeness1.692
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.56522
Fragments1
Non HAtoms23
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Amides1
StereoCon

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