(5Z)-5-[(4-nitrophenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C18H14N2O3S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(4-nitrophenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-5-[(4-nitrophenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C18H14N2O3S2
Smiles	[O-][N+](c1ccc(/C=C(/C(N2CCc3ccccc3)=O)\SC2=S)cc1)=O
InChI	InChI=1S/C18H14N2O3S2/c21-17-16(12-14-6-8-15(9-7-14)20(22)23)25-18(24)19(17)11-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2
InChIK	XGQCTTAIFOXQEN-UHFFFAOYSA-N
TotalMolweight	370.452
Molweight	370.452
MonoisotopicMass	370.044583
CLogP	2.3237
CLogS	-5.033
H Acceptors	5
TotalSurfaceArea	273.67
Relative PSA	0.338
PolarSurfaceArea	123.52
Druglikeness	-0.89167
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	4
Amides	1
AcidicOxygens	1
StereoCon

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