2-[(2E)-2-(4-bromophenyl)sulfonylimino-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide

Formula:C23H17N3O4BrClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(2E)-2-(4-bromophenyl)sulfonylimino-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide is not a drug-like molecule.

MolName2-[(2E)-2-(4-bromophenyl)sulfonylimino-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide
MolecularFormulaC23H17N3O4BrClS2
SmilesO=C(CC(C(N1c2ccccc2)=O)S/C1=N/S(c(cc1)ccc1Br)(=O)=O)Nc(cc1)ccc1Cl
InChIInChI=1S/C23H17BrClN3O4S2/c24-15-6-12-19(13-7-15)34(31,32)27-23-28(18-4-2-1-3-5-18)22(30)20(33-23)14-21(29)26-17-10-8-16(25)9-11-17/h1-13,20H,14H2,(H,26,29)/t20-/m1/s1
InChIKCVKNTQXEDNLPCA-HXUWFJFHSA-N
TotalMolweight578.894
Molweight578.894
MonoisotopicMass576.953235
CLogP5.1705
CLogS-6.904
H Acceptors7
H Donors1
TotalSurfaceArea365.89
Relative PSA0.26967
PolarSurfaceArea129.59
Druglikeness6.001
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.52941
Fragments1
Non HAtoms34
NonCHAtoms11
Electronegative Atoms11
StereoCenters1
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms4
Symmetricatoms7
Amides2
StereoConracemate

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