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(5Z)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-3-[(Z)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C19H10N2O5Cl2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-3-[(Z)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.
MolName(5Z)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-3-[(Z)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormulaC19H10N2O5Cl2S2
SmilesO=C(/C(/SC1=S)=C/c(cc2OCOc2c2)c2Cl)N1N=Cc(cc1OCOc1c1)c1Cl
InChIInChI=1S/C19H10Cl2N2O5S2/c20-11-4-15-13(25-7-27-15)1-9(11)3-17-18(24)23(19(29)30-17)22-6-10-2-14-16(5-12(10)21)28-8-26-14/h1-6H,7-8H2
InChIKTZYXSANMBNHZOO-UHFFFAOYSA-N
TotalMolweight481.335
Molweight481.335
MonoisotopicMass479.940817
CLogP4.49
CLogS-7.989
H Acceptors7
TotalSurfaceArea318.6
Relative PSA0.35653
PolarSurfaceArea126.98
Druglikeness4.785
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.53333
Fragments1
Non HAtoms30
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond3
Rings Closures5
Small Rings5
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms8
StereoCon

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