4-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]butanamide

Formula:C24H19N3O2Cl2S3 Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]butanamide is not a drug-like molecule.

MolName	4-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]butanamide
MolecularFormula	C24H19N3O2Cl2S3
Smiles	O=C(CCCN(C(/C(/S1)=C/c(cccc2)c2Cl)=O)C1=S)Nc1ncc(Cc(cc2)ccc2Cl)s1
InChI	InChI=1S/C24H19Cl2N3O2S3/c25-17-9-7-15(8-10-17)12-18-14-27-23(33-18)28-21(30)6-3-11-29-22(31)20(34-24(29)32)13-16-4-1-2-5-19(16)26/h1-2,4-5,7-10,13-14H,3,6,11-12H2,(H,27,28,30)
InChIK	MPSVKYZVJUWVDU-UHFFFAOYSA-N
TotalMolweight	548.538
Molweight	548.538
MonoisotopicMass	547.001641
CLogP	5.8337
CLogS	-7.978
H Acceptors	5
H Donors	1
TotalSurfaceArea	392.03
Relative PSA	0.30077
PolarSurfaceArea	147.93
Druglikeness	4.3233
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! thiazol-2-ylamine
Shape Index	0.64706
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	6
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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1 - 4-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]butanamide | 2 - 4-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]butanamide

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