(5Z)-3-benzyl-5-[[4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C25H20N2O5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-benzyl-5-[[4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-3-benzyl-5-[[4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C25H20N2O5S2
Smiles	[O-][N+](c(cc1)ccc1OCCOc1ccc(/C=C(/C(N2Cc3ccccc3)=O)\SC2=S)cc1)=O
InChI	InChI=1S/C25H20N2O5S2/c28-24-23(34-25(33)26(24)17-19-4-2-1-3-5-19)16-18-6-10-21(11-7-18)31-14-15-32-22-12-8-20(9-13-22)27(29)30/h1-13,16H,14-15,17H2
InChIK	FGUWFNROBYQCPH-UHFFFAOYSA-N
TotalMolweight	492.575
Molweight	492.575
MonoisotopicMass	492.081363
CLogP	3.2486
CLogS	-6.189
H Acceptors	7
TotalSurfaceArea	367.19
Relative PSA	0.30638
PolarSurfaceArea	141.98
Druglikeness	-8.1361
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.67647
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	8
Symmetricatoms	6
Amides	1
AcidicOxygens	1
StereoCon

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