(5Z)-5-benzylidene-2-imino-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one

Formula:C17H11N2OF3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-benzylidene-2-imino-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one is a drug-like molecule.

MolName(5Z)-5-benzylidene-2-imino-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
MolecularFormulaC17H11N2OF3S
SmilesN=C(N(C1=O)c2cc(C(F)(F)F)ccc2)S/C1=C\c1ccccc1
InChIInChI=1S/C17H11F3N2OS/c18-17(19,20)12-7-4-8-13(10-12)22-15(23)14(24-16(22)21)9-11-5-2-1-3-6-11/h1-10,21H
InChIKVJIGRQJYSDNKAI-UHFFFAOYSA-N
TotalMolweight348.347
Molweight348.347
MonoisotopicMass348.054417
CLogP3.6868
CLogS-4.59
H Acceptors3
H Donors1
TotalSurfaceArea239.54
Relative PSA0.2074
PolarSurfaceArea69.46
Druglikeness-3.6493
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.54167
Fragments1
Non HAtoms24
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms4
Amides1
StereoCon

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