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

Formula:C23H16N2O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-5-[[3-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-5-[[3-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C23H16N2O4S2
Smiles	[O-][N+](c1ccc(COc2cccc(/C=C(\C(N3c4ccccc4)=O)/SC3=S)c2)cc1)=O
InChI	InChI=1S/C23H16N2O4S2/c26-22-21(31-23(30)24(22)18-6-2-1-3-7-18)14-17-5-4-8-20(13-17)29-15-16-9-11-19(12-10-16)25(27)28/h1-14H,15H2
InChIK	WAKXFSSJOQKGFH-UHFFFAOYSA-N
TotalMolweight	448.522
Molweight	448.522
MonoisotopicMass	448.055148
CLogP	3.3188
CLogS	-6.784
H Acceptors	6
TotalSurfaceArea	329.67
Relative PSA	0.31092
PolarSurfaceArea	132.75
Druglikeness	-2.4236
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	4
Amides	1
AcidicOxygens	1
StereoCon

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