(2Z)-N-(4-chlorophenyl)-2-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide

Formula:C25H15N3O2Cl2S Mutagenic:none Tumorigenic:high Reproductive Effective:high (2Z)-N-(4-chlorophenyl)-2-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide is not a drug-like molecule.

MolName	(2Z)-N-(4-chlorophenyl)-2-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide
MolecularFormula	C25H15N3O2Cl2S
Smiles	N#C/C(/C(Nc(cc1)ccc1Cl)=O)=C(\N(C1=O)c2ccccc2)/S/C1=C/c(cccc1)c1Cl
InChI	InChI=1S/C25H15Cl2N3O2S/c26-17-10-12-18(13-11-17)29-23(31)20(15-28)25-30(19-7-2-1-3-8-19)24(32)22(33-25)14-16-6-4-5-9-21(16)27/h1-14H,(H,29,31)
InChIK	BBKHKHQPDAOTIK-UHFFFAOYSA-N
TotalMolweight	492.385
Molweight	492.385
MonoisotopicMass	491.026201
CLogP	5.9265
CLogS	-7.785
H Acceptors	5
H Donors	1
TotalSurfaceArea	354.21
Relative PSA	0.20366
PolarSurfaceArea	98.5
Druglikeness	0.64333
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	polar activated DB; twice activated DB
Shape Index	0.48485
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	4
Amides	2
StereoCon

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1 - (2Z)-N-(4-chlorophenyl)-2-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide | 2 - (2Z)-N-(4-chlorophenyl)-2-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide

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