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(5E)-5-[[3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one

Formula:C24H10N2O4Br2F6S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-5-[[3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one is not a drug-like molecule.
MolName(5E)-5-[[3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
MolecularFormulaC24H10N2O4Br2F6S2
Smiles[O-][N+](c(cc(C(F)(F)F)cc1)c1Oc(c(Br)cc(/C=C(\C(N1c2cc(C(F)(F)F)ccc2)=O)/SC1=S)c1)c1Br)=O
InChIInChI=1S/C24H10Br2F6N2O4S2/c25-15-6-11(7-16(26)20(15)38-18-5-4-13(24(30,31)32)10-17(18)34(36)37)8-19-21(35)33(22(39)40-19)14-3-1-2-12(9-14)23(27,28)29/h1-10H
InChIKFIYFMIWTBHZMON-UHFFFAOYSA-N
TotalMolweight728.281
Molweight728.281
MonoisotopicMass725.835288
CLogP6.5133
CLogS-10.964
H Acceptors6
TotalSurfaceArea412.09
Relative PSA0.24873
PolarSurfaceArea132.75
Druglikeness-11.263
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro
Shape Index0.5
Fragments1
Non HAtoms40
NonCHAtoms16
Electronegative Atoms16
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms6
Symmetricatoms7
Amides1
AcidicOxygens1
StereoCon

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