(5Z)-3-(1,1-dioxothiolan-3-yl)-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C20H17NO4S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-(1,1-dioxothiolan-3-yl)-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-3-(1,1-dioxothiolan-3-yl)-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C20H17NO4S3
Smiles	O=C(/C(/S1)=C/c2cc(Oc3ccccc3)ccc2)N(C(CC2)CS2(=O)=O)C1=S
InChI	InChI=1S/C20H17NO4S3/c22-19-18(27-20(26)21(19)15-9-10-28(23,24)13-15)12-14-5-4-8-17(11-14)25-16-6-2-1-3-7-16/h1-8,11-12,15H,9-10,13H2/t15-/m1/s1
InChIK	NCXYXUNCBNMNPZ-OAHLLOKOSA-N
TotalMolweight	431.556
Molweight	431.556
MonoisotopicMass	431.031969
CLogP	2.1564
CLogS	-5.979
H Acceptors	5
TotalSurfaceArea	301.34
Relative PSA	0.33404
PolarSurfaceArea	129.45
Druglikeness	0.52442
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	1
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	3
Amides	1
StereoCon	racemate

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