(5E)-5-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C20H11N2O4ClS2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-5-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-5-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C20H11N2O4ClS2
Smiles	[O-][N+](c(cc1)cc(Cl)c1-c1ccc(/C=C(\C(N2c3ccccc3)=O)/SC2=S)o1)=O
InChI	InChI=1S/C20H11ClN2O4S2/c21-16-10-13(23(25)26)6-8-15(16)17-9-7-14(27-17)11-18-19(24)22(20(28)29-18)12-4-2-1-3-5-12/h1-11H
InChIK	SXZLMCMBOMPILF-UHFFFAOYSA-N
TotalMolweight	442.902
Molweight	442.902
MonoisotopicMass	441.984875
CLogP	3.5156
CLogS	-7.639
H Acceptors	6
TotalSurfaceArea	311.02
Relative PSA	0.34278
PolarSurfaceArea	136.66
Druglikeness	-1.1835
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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