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(5Z)-3-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5-[(2,3,4,5,6-pentafluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C17H5N2OCl2F5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5-[(2,3,4,5,6-pentafluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.
MolName(5Z)-3-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5-[(2,3,4,5,6-pentafluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormulaC17H5N2OCl2F5S2
SmilesO=C(/C(/SC1=S)=C/c(c(F)c(c(F)c2F)F)c2F)N1/N=C\c(ccc(Cl)c1)c1Cl
InChIInChI=1S/C17H5Cl2F5N2OS2/c18-7-2-1-6(9(19)3-7)5-25-26-16(27)10(29-17(26)28)4-8-11(20)13(22)15(24)14(23)12(8)21/h1-5H
InChIKKYJDTPHDNJINLB-UHFFFAOYSA-N
TotalMolweight483.268
Molweight483.268
MonoisotopicMass481.914047
CLogP4.7712
CLogS-8.137
H Acceptors3
TotalSurfaceArea309.83
Relative PSA0.23752
PolarSurfaceArea90.06
Druglikeness3.5266
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index0.55172
Fragments1
Non HAtoms29
NonCHAtoms12
Electronegative Atoms12
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms4
StereoCon

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