N-[(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide

Formula:C33H24N4O2S2 Mutagenic:high Tumorigenic:low Reproductive Effective:high N-[(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide is not a drug-like molecule.

MolName	N-[(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide
MolecularFormula	C33H24N4O2S2
Smiles	O=C(Cc1ccccc1)NN(C(/C(/S1)=C/c(cc2)ccc2-n(c(-c2ccccc2)c2)nc2-c2ccccc2)=O)C1=S
InChI	InChI=1S/C33H24N4O2S2/c38-31(21-23-10-4-1-5-11-23)35-37-32(39)30(41-33(37)40)20-24-16-18-27(19-17-24)36-29(26-14-8-3-9-15-26)22-28(34-36)25-12-6-2-7-13-25/h1-20,22H,21H2,(H,35,38)
InChIK	NSTQLYBLHCJXLH-UHFFFAOYSA-N
TotalMolweight	572.712
Molweight	572.712
MonoisotopicMass	572.134066
CLogP	4.1385
CLogS	-7.94
H Acceptors	6
H Donors	1
TotalSurfaceArea	432.69
Relative PSA	0.24133
PolarSurfaceArea	124.62
Druglikeness	5.2009
Mutagenic	high
Tumorigenic	low
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.53659
Fragments	1
Non HAtoms	41
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	29
Sp3Atoms	3
Symmetricatoms	8
Aromatic Nitrogens	2
StereoCon

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1 - N-[(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide | 2 - N-[(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide

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