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N'-[2-(2,4-dichlorophenoxy)acetyl]-3-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanehydrazide

Formula:C21H15N3O4Cl4S2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N'-[2-(2,4-dichlorophenoxy)acetyl]-3-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanehydrazide is not a drug-like molecule.
MolNameN'-[2-(2,4-dichlorophenoxy)acetyl]-3-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanehydrazide
MolecularFormulaC21H15N3O4Cl4S2
SmilesO=C(CCN(C(/C(/S1)=C/c(ccc(Cl)c2)c2Cl)=O)C1=S)NNC(COc(ccc(Cl)c1)c1Cl)=O
InChIInChI=1S/C21H15Cl4N3O4S2/c22-12-2-1-11(14(24)8-12)7-17-20(31)28(21(33)34-17)6-5-18(29)26-27-19(30)10-32-16-4-3-13(23)9-15(16)25/h1-4,7-9H,5-6,10H2,(H,26,29)(H,27,30)
InChIKJDUJNDUJAFNCOD-UHFFFAOYSA-N
TotalMolweight579.311
Molweight579.311
MonoisotopicMass576.925805
CLogP3.4533
CLogS-7.588
H Acceptors7
H Donors2
TotalSurfaceArea393.86
Relative PSA0.30742
PolarSurfaceArea145.13
Druglikeness5.4293
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functions
Shape Index0.64706
Fragments1
Non HAtoms34
NonCHAtoms13
Electronegative Atoms13
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Amides1
StereoCon

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