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2-(thiophen-2-ylsulfonylamino)-N-[(Z)-[4-[(Z)-[[2-(thiophen-2-ylsulfonylamino)benzoyl]hydrazinylidene]methyl]phenyl]methylideneamino]benzamide

Formula:C30H24N6O6S4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(thiophen-2-ylsulfonylamino)-N-[(Z)-[4-[(Z)-[[2-(thiophen-2-ylsulfonylamino)benzoyl]hydrazinylidene]methyl]phenyl]methylideneamino]benzamide is not a drug-like molecule.
MolName2-(thiophen-2-ylsulfonylamino)-N-[(Z)-[4-[(Z)-[[2-(thiophen-2-ylsulfonylamino)benzoyl]hydrazinylidene]methyl]phenyl]methylideneamino]benzamide
MolecularFormulaC30H24N6O6S4
SmilesO=C(c(cccc1)c1NS(c1cccs1)(=O)=O)N/N=C\c1ccc(/C=N\NC(c(cccc2)c2NS(c2cccs2)(=O)=O)=O)cc1
InChIInChI=1S/C30H24N6O6S4/c37-29(23-7-1-3-9-25(23)35-45(39,40)27-11-5-17-43-27)33-31-19-21-13-15-22(16-14-21)20-32-34-30(38)24-8-2-4-10-26(24)36-46(41,42)28-12-6-18-44-28/h1-20,35-36H,(H,33,37)(H,34,38)
InChIKJYQAMQZUTJTPOY-UHFFFAOYSA-N
TotalMolweight692.821
Molweight692.821
MonoisotopicMass692.064014
CLogP5.32
CLogS-8.326
H Acceptors12
H Donors4
TotalSurfaceArea492.2
Relative PSA0.39175
PolarSurfaceArea248.5
Druglikeness6.1158
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.56522
Fragments1
Non HAtoms46
NonCHAtoms16
Electronegative Atoms16
Rotatable Bond10
Rings Closures5
Small Rings5
Aromatic Rings5
Aromatic Atoms28
Sp3Atoms2
Symmetricatoms25
Amides2
StereoCon

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