(4E)-4-[[4-[(E)-(5-oxo-2-phenyl-1,3-thiazol-4-ylidene)methyl]phenyl]methylidene]-2-phenyl-1,3-thiazol-5-one

Formula:C26H16N2O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-4-[[4-[(E)-(5-oxo-2-phenyl-1,3-thiazol-4-ylidene)methyl]phenyl]methylidene]-2-phenyl-1,3-thiazol-5-one is not a drug-like molecule.

MolName(4E)-4-[[4-[(E)-(5-oxo-2-phenyl-1,3-thiazol-4-ylidene)methyl]phenyl]methylidene]-2-phenyl-1,3-thiazol-5-one
MolecularFormulaC26H16N2O2S2
SmilesO=C1SC(c2ccccc2)=N/C1=C/c1ccc(/C=C2/N=C(c3ccccc3)SC2=O)cc1
InChIInChI=1S/C26H16N2O2S2/c29-25-21(27-23(31-25)19-7-3-1-4-8-19)15-17-11-13-18(14-12-17)16-22-26(30)32-24(28-22)20-9-5-2-6-10-20/h1-16H
InChIKPFOTXFINRCOJDQ-UHFFFAOYSA-N
TotalMolweight452.557
Molweight452.557
MonoisotopicMass452.065318
CLogP5.8968
CLogS-6.78
H Acceptors4
TotalSurfaceArea331.62
Relative PSA0.25354
PolarSurfaceArea109.46
Druglikeness2.011
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.625
Fragments1
Non HAtoms32
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures5
Small Rings5
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms19
StereoCon

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